SCHEMBL2063068

SCHEMBL2063068

COC(=O)c1ccc(OCc2ccccc2)c(OC)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.73
NPC1 O15118 2/20 0.73
RAB9A P51151 2/20 0.73
HPGD P15428 2/20 0.73
MAPT P10636 3/20 0.70
CYP1A2 P05177 1/20 0.70
CYP3A4 P08684 1/20 0.70
CYP2C9 P11712 1/20 0.70
CYP2C19 P33261 1/20 0.70
SMPD1 P17405 2/20 0.67
HDAC1 Q13547 1/20 0.67
HDAC8 Q9BY41 1/20 0.67
HDAC6 Q9UBN7 1/20 0.67
KDM4E B2RXH2 2/20 0.66
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
MRGPRX4 Q96LA9 2/20 0.61
RXRA P19793 1/20 0.61
LMNA P02545 1/20 0.59
ATM Q13315 1/20 0.59

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
Bicarbonate SCHEMBL5499351 0.96 SMN1; SMN2 (0.68) SMN1; SMN2NPC1RAB9AHPGDMAPT
Bicarbonate SCHEMBL5499350 0.96 SMN1; SMN2 (0.68) SMN1; SMN2NPC1RAB9AHPGDMAPT
SCHEMBL2188210 0.94 SMPD1 (0.76) SMN1; SMN2NPC1RAB9AHPGDMAPT
SCHEMBL3245222 0.94 SMPD1 (0.67) SMN1; SMN2NPC1RAB9AHPGDMAPT
SCHEMBL1781433 0.92 SMN1; SMN2 (0.63) SMN1; SMN2NPC1RAB9AHPGDMAPT
SCHEMBL11286951 0.91 NPC1 (0.78) SMN1; SMN2NPC1RAB9AHPGDMAPT
SCHEMBL2087641 0.90 NPC1 (0.71) SMN1; SMN2NPC1RAB9AHPGDMAPT
Bicarbonate SCHEMBL5504807 0.90 SMPD1 (0.62) SMN1; SMN2NPC1RAB9AHPGDMAPT
Bicarbonate SCHEMBL5504809 0.90 SMPD1 (0.62) SMN1; SMN2NPC1RAB9AHPGDMAPT
SCHEMBL18660058 0.89 SMN1; SMN2 (0.62) SMN1; SMN2NPC1RAB9AHPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102603718-B Synthesis method of cediranib CHEMPROSPECT PHARMTECH CO LTD 2014-01-29 CN claimed
CN-102603718-A Synthesis method of cediranib WUHAN CATALIBI UNI PHARMA INC LTD 2012-07-25 CN claimed
US-20240067652-A1 METHOD OF PREPARING INDOLINOBENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. (US) 2024-02-29 US disclosed
US-20240067652-A1 METHOD OF PREPARING INDOLINOBENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. (US) 2024-02-29 US disclosed
CN-111253385-B Heterocyclic compound, preparation method and application 遵义医科大学珠海校区 2023-11-24 CN disclosed
US-11760759-B2 Process for preparing substituted indolines IMMUNOGEN, INC. (US) 2023-09-19 US disclosed
US-11760759-B2 Process for preparing substituted indolines IMMUNOGEN, INC. (US) 2023-09-19 US disclosed
EP-2956138-B1 THERAPEUTIC COMPOUNDS AND USES THEREOF KALA PHARMACEUTICALS INC (US) 2022-06-22 EP disclosed
EP-3590924-B1 NOVEL ISOINDOLINE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF KANGPU BIOPHARMACEUTICALS LTD (CN) 2021-10-27 EP disclosed
US-20210292329-A1 METHODS OF PREPARING INDOLINOBENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2021-09-23 US disclosed
US-10968228-B2 Methods of preparing substituted 12a,13-dihydro-6H-benzo[5,6][1,4]diazepino[1,2-a]indoles IMMUNOGEN, INC. (US) 2021-04-06 US disclosed
CN-1165532-C Substituted 3-cyanoquinolines as protein tyrosine kinases inhibitors ���Ͽع����޹�˾ 2004-09-08 CN disclosed
CN-1144786-C Substituted 3-cyanoquinolines as protein tyrosine kinases inhibitors 2004-04-07 CN disclosed
US-6689772-B1 ANTINEOPLASTIC AGENTS; OSTEOPOROSIS; POLYCYSTIC KIDNEY DISEASE; ANTIVIRAL AGENTS WYETH 2004-02-10 US disclosed
US-6521618-B2 Antineoplastic agents, agents for treatment of osteoporosis and polycystic kidney disease WYETH 2003-02-18 US disclosed
EP-1268431-A1 3-CYANOQUINOLINES,3-CYANO-1,6-NAPHTHYRIDINES, AND 3-CYANO-1,7-NAPHTHYRIDINES AS PROTEIN KINASE INHIBITORS Wyeth (US) 2003-01-02 EP disclosed
US-20020026052-A1 3-cyanoquinolines, 3-cyano-1,6-naphthyridines, and 3-cyano-1,7-naphthyridines as protein kinase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 2002-02-28 US disclosed
CN-1320121-A Substituted 3-cyanoquinolines as protein tyrosine kinase inhibitors AMERICAN CYANAMID CO (US) 2001-10-31 CN disclosed
CN-1320118-A Substituted 3-cyanoquinolines as protein tyrosine kinases inhibitors AMERICAN CYANAMID CO (US) 2001-10-31 CN disclosed
WO-2001072711-A1 3-CYANOQUINOLINES,3-CYANO-1,6-NAPHTHYRIDINES, AND 3-CYANO-1,7-NAPHTHYRIDINES AS PROTEIN KINASE INHIBITORS WYETH (US) 2001-10-04 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 (5 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-20240067652-A1 METHOD OF PREPARING INDOLINOBENZODIAZEPINE DERIVATIVES HTR3B, HTR3C, HTR3D SMN1; SMN2 2332/4885NPC1 3183/4885RAB9A 1350/4885
US-10968228-B2 Methods of preparing substituted 12a,13-dihydro-6H-benzo[5,6][1,4]diazepino[1,2-a]indoles TPH1, HTR1B, HTR1A SMN1; SMN2 2744/4885NPC1 2236/4885RAB9A 1795/4885
US-20210292329-A1 METHODS OF PREPARING INDOLINOBENZODIAZEPINE DERIVATIVES HTR3C, HTR3B, HTR3D SMN1; SMN2 2248/4885NPC1 2992/4885RAB9A 1340/4885
US-11760759-B2 Process for preparing substituted indolines IDO2, IDO1, INMT SMN1; SMN2 2184/4885NPC1 4692/4885RAB9A 1864/4885
US-20020026052-A1 3-cyanoquinolines, 3-cyano-1,6-naphthyridines, and 3-cyano-1,7-naphthyridines as protein kinase inhibitors PKD1, PKD2, CSNK1A1 SMN1; SMN2 4511/4885NPC1 653/4885RAB9A 1357/4885

“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.