SCHEMBL985935

SCHEMBL985935

CCOC(=O)Cc1nc2ccc(N3CCN(C)CC3)cc2[nH]1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.57
BRD4 O60885 8/20 0.53
ALDH1A1 P00352 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
MEN1 O00255 2/20 0.53
MAPT P10636 2/20 0.53
BLM P54132 2/20 0.53
KMT2A Q03164 2/20 0.53
SLCO2B1 O94956 1/20 0.53
GLA P06280 1/20 0.53
RECQL P46063 1/20 0.53
BCL2L1 Q07817 1/20 0.53
SLCO1B3 Q9NPD5 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
SLCO1B1 Q9Y6L6 1/20 0.53
TOP1 P11387 2/20 0.49
TOP2A P11388 2/20 0.49
HPGD P15428 1/20 0.49
AKT1 P31749 1/20 0.48
SIRT2 Q8IXJ6 2/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20293286 0.96 HSD17B10 (0.53) HSD17B10BRD4ALDH1A1SMN1; SMN2MEN1
SCHEMBL3741042 0.91 HSD17B10 (0.57) HSD17B10BRD4ALDH1A1SMN1; SMN2MEN1
SCHEMBL25780156 0.90 HSD17B10 (0.56) HSD17B10BRD4ALDH1A1SMN1; SMN2MEN1
SCHEMBL3383472 0.90 HSD17B10 (0.58) HSD17B10BRD4ALDH1A1SMN1; SMN2MEN1
SCHEMBL3378290 0.89 AKT1 (0.62) HSD17B10BRD4ALDH1A1SMN1; SMN2MEN1
SCHEMBL25780858 0.89 HSD17B10 (0.54) HSD17B10BRD4ALDH1A1SMN1; SMN2MEN1
SCHEMBL25780664 0.88 HSD17B10 (0.56) HSD17B10BRD4ALDH1A1SMN1; SMN2MEN1
SCHEMBL25780050 0.88 HSD17B10 (0.53) HSD17B10BRD4ALDH1A1SMN1; SMN2MEN1
SCHEMBL25781087 0.86 HSD17B10 (0.54) HSD17B10BRD4ALDH1A1SMN1; SMN2MEN1
SCHEMBL25780286 0.86 HSD17B10 (0.51) HSD17B10BRD4ALDH1A1SMN1; SMN2MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 117 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108610293-B Method for preparing dorvitinib intermediate by adopting microchannel reaction device 南京工业大学 2020-08-04 CN claimed
WO-2023109902-A1 FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF IN MEDICINE 海思科医药集团股份有限公司 2023-06-22 WO disclosed
CN-109721620-B HPK1 inhibitors and uses thereof 药捷安康(南京)科技股份有限公司 2022-05-13 CN disclosed
US-20220002313-A1 HPK1 INHIBITORS AND METHODS OF USING SAME UNIVERSITY HEALTH NETWORK (CA) 2022-01-06 US disclosed
CN-113214287-A HPK1 inhibitors and methods of use thereof 大学健康网络 2021-08-06 CN disclosed
US-11059832-B2 HPK1 inhibitors and methods of using same UNIVERSITY HEALTH NETWORK (CA) 2021-07-13 US disclosed
CN-107922431-B HPK1 inhibitors and methods of use thereof 大学健康网络 2021-06-04 CN disclosed
EP-3322711-B1 HPK1 INHIBITORS AND METHODS OF USING SAME UNIV HEALTH NETWORK (CA) 2021-03-10 EP disclosed
CN-108610293-B Method for preparing dorvitinib intermediate by adopting microchannel reaction device 南京工业大学 2020-08-04 CN disclosed
US-20200190104-A1 HPK1 INHIBITORS AND METHODS OF USING SAME UNIVERSITY HEALTH NETWORK (CA) 2020-06-18 US disclosed
US-20050209247-A1 Lactate salt of 4-amino-5-fluoro-3-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]quinolin-2(1H)-one; improved water solubility and physicochemical properties (e.g., stability, hygroscopicity, crystallinity, and compactibility); vascular endothelial growth factor receptor tyrosine kinase inhibitors CHIRON CORPORATION 2005-09-22 US disclosed
US-20050203101-A1 Benzimidazole quinolinones and uses thereof CHIRON CORPORATION 2005-09-15 US disclosed
WO-2005082340-A2 MODULATION OF INFLAMMATORY AND METASTATIC PROCESSES CHIRON CORPORATION (US) 2005-09-09 WO disclosed
US-20050137399-A1 A lithium-free reaction to produce a substituted/unsubstituted 4-amino-3-benzimidazol-2-yl-quinolin-2-one compound by reacting a 2-aminobenzonitrile with a 2-alkyloxycarbonylmethyl-benzimidazole in a solvent in the presence of a sodium or potassium salt of a base; excellent yields CHIRON CORPORATION 2005-06-23 US disclosed
EP-1539754-A2 BENZIMIDAZOLE QUINOLINONES AND USES THEREOF Chiron Corporation (US) 2005-06-15 EP disclosed
WO-2005046590-A2 METHODS FOR SYNTHESIZING QUINOLINONE COMPOUNDS CHIRON CORPORATION (US) 2005-05-26 WO disclosed
WO-2005046589-A2 PHARMACEUTICALLY ACCEPTABLE SALTS OF QUINOLINONE COMPOUNDS HAVING IMPROVED PHARMACEUTICAL PROPERTIES CHIRON CORPORATION (US) 2005-05-26 WO disclosed
WO-2005047244-A2 INHIBITION OF FGFR3 AND TREATMENT OF MULTIPLE MYELOMA CHIRON CORPORATION (US) 2005-05-26 WO disclosed
US-20040092535-A1 Benzimidazole quinolinones and uses thereof CHIRON CORPORATION 2004-05-13 US disclosed
WO-2004018419-A2 BENZIMIDAZOLE QUINOLINONES AND USES THEREOF CHIRON CORPORATION (US) 2004-03-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11059832-B2 HPK1 inhibitors and methods of using same PDXK, PDK3, PDK2 HSD17B10 1233/4885BRD4 1780/4885ALDH1A1 2442/4885
US-20050137399-A1 A lithium-free reaction to produce a substituted/unsubstituted 4-amino-3-benzimidazol-2-yl-quinolin-2-one compound by reacting a 2-aminobenzonitrile with a 2-alkyloxycarbonylmethyl-benzimidazole in a solvent in the presence of a sodium or potassium salt of a base; excellent yields KCNJ2, KCNN2, KCNN1 HSD17B10 2141/4885BRD4 55/4885ALDH1A1 2263/4885
US-20050203101-A1 Benzimidazole quinolinones and uses thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TP53, PBRM1 HSD17B10 4442/4885BRD4 51/4885ALDH1A1 1196/4885
US-20040092535-A1 Benzimidazole quinolinones and uses thereof GAA, ALPI, IL4I1 HSD17B10 755/4885BRD4 710/4885ALDH1A1 152/4885
US-20220002313-A1 HPK1 INHIBITORS AND METHODS OF USING SAME PDXK, PDK3, PDK2 HSD17B10 1201/4885BRD4 1938/4885ALDH1A1 2458/4885
US-20200190104-A1 HPK1 INHIBITORS AND METHODS OF USING SAME PDXK, PDK3, PDK2 HSD17B10 1233/4885BRD4 1780/4885ALDH1A1 2442/4885
US-20050209247-A1 Lactate salt of 4-amino-5-fluoro-3-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]quinolin-2(1H)-one; improved water solubility and physicochemical properties (e.g., stability, hygroscopicity, crystallinity, and compactibility); vascular endothelial growth factor receptor tyrosine kinase inhibitors KDR, FLT4, FLT1 HSD17B10 2437/4885BRD4 2562/4885ALDH1A1 1023/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.