SCHEMBL20702183

SCHEMBL20702183

COc1ccc(Cn2nc(N)c([N+](=O)[O-])c2C)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.59
NPC1 O15118 1/20 0.59
KDM4E B2RXH2 1/20 0.51
LMNA P02545 1/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 2/20 0.48
DCTPP1 Q9H773 3/20 0.47
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP2D6 P10635 1/20 0.43
HPGD P15428 1/20 0.42
GFER P55789 1/20 0.42
PDE8B O95263 1/20 0.41

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
SCHEMBL16832564 0.87 RAB9A (0.77) RAB9ANPC1KDM4ELMNAMAPK1
SCHEMBL19762436 0.84 RAB9A (0.58) RAB9ANPC1KDM4ELMNAMAPK1
SCHEMBL16832143 0.81 RAB9A (0.56) RAB9ANPC1KDM4ELMNAMAPK1
SCHEMBL20281262 0.79 GAA (0.53) KDM4EL3MBTL1MAPTALDH1A1CYP1A2
SCHEMBL23486567 0.79 PDE4D (0.55) RAB9ANPC1KDM4ELMNAMAPK1
SCHEMBL18483483 0.79 RAB9A (0.61) RAB9ANPC1KDM4ELMNAMAPK1
SCHEMBL9353161 0.79 RAB9A (0.49) RAB9ANPC1KDM4ELMNAMAPK1
SCHEMBL16855655 0.76 RAB9A (0.58) RAB9ANPC1KDM4ELMNAMAPK1
SCHEMBL19762437 0.76 RAB9A (0.61) RAB9ANPC1KDM4ELMNAMAPK1
Hexane SCHEMBL23453729 0.76 PDE4D (0.52) RAB9ANPC1KDM4ELMNAMAPK1

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4316492-B1 COMBINATION OF A MULTIKINASE INHIBITOR WITH A PD-1/PD-L1 ANTIBODY AND USES THEREOF TRANSTHERA SCIENCES NANJING INC (CN) 2025-12-03 EP disclosed
EP-3447056-B1 MULTI-KINASE INHIBITOR COMPOUND, AND CRYSTAL FORM AND USE THEREOF TRANSTHERA SCIENCES NANJING INC (CN) 2025-04-30 EP disclosed
US-20250082650-A1 COMBINED USE OF MULTIKINASE INHIBITOR TRANSTHERA SCIENCES (NANJING), INC. (CN) 2025-03-13 US disclosed
EP-4316492-A1 COMBINED USE OF MULTIKINASE INHIBITOR Transthera Sciences (Nanjing), Inc. (CN) 2024-02-07 EP disclosed
US-11718620-B2 Method for treating a cancer mediated by abnormality of multi-kinases TRANSTHERA SCIENCES (NANJING), INC. (CN) 2023-08-08 US disclosed
US-11718620-B2 Method for treating a cancer mediated by abnormality of multi-kinases TRANSTHERA SCIENCES (NANJING), INC. (CN) 2023-08-08 US disclosed
US-11718620-B2 Method for treating a cancer mediated by abnormality of multi-kinases TRANSTHERA SCIENCES (NANJING), INC. (CN) 2023-08-08 US disclosed
WO-2022206758-A1 COMBINED USE OF MULTIKINASE INHIBITOR 药捷安康(南京)科技股份有限公司 2022-10-06 WO disclosed
CN-115120598-A Combined use of multi-kinase inhibitors 药捷安康(南京)科技股份有限公司 2022-09-30 CN disclosed
US-20210130354-A1 MULTI-KINASE INHIBITOR COMPOUND, AND CRYSTAL FORM AND USE THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2021-05-06 US disclosed
US-20210130354-A1 MULTI-KINASE INHIBITOR COMPOUND, AND CRYSTAL FORM AND USE THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2021-05-06 US disclosed
US-10889586-B2 Multi-kinase inhibitor compound, and crystal form and use thereof NANJING TRANSTHERA BIOSCIENCES CO. LTD. (CN) 2021-01-12 US disclosed
US-10889586-B2 Multi-kinase inhibitor compound, and crystal form and use thereof NANJING TRANSTHERA BIOSCIENCES CO. LTD. (CN) 2021-01-12 US disclosed
US-20190152972-A1 MULTI-KINASE INHIBITOR COMPOUND, AND CRYSTAL FORM AND USE THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2019-05-23 US disclosed
US-20190152972-A1 MULTI-KINASE INHIBITOR COMPOUND, AND CRYSTAL FORM AND USE THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2019-05-23 US disclosed
US-10208042-B1 Multi-kinase inhibitor compound, and crystal form and use thereof NANJING TRANSTHERA BIOSCIENCES CO. LTD. (CN) 2019-02-19 US disclosed
US-10208042-B1 Multi-kinase inhibitor compound, and crystal form and use thereof NANJING TRANSTHERA BIOSCIENCES CO. LTD. (CN) 2019-02-19 US disclosed
US-20190040064-A1 MULTI-KINASE INHIBITOR COMPOUND, AND CRYSTAL FORM AND USE THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2019-02-07 US disclosed
US-20190040064-A1 MULTI-KINASE INHIBITOR COMPOUND, AND CRYSTAL FORM AND USE THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2019-02-07 US 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-20210130354-A1 MULTI-KINASE INHIBITOR COMPOUND, AND CRYSTAL FORM AND USE THEREOF MAP2K5, MAP3K1, MAP3K19 RAB9A 1008/4885NPC1 3734/4885KDM4E 597/4885
US-20190152972-A1 MULTI-KINASE INHIBITOR COMPOUND, AND CRYSTAL FORM AND USE THEREOF MAP3K1, MAP2K5, MAP3K5 RAB9A 1153/4885NPC1 3436/4885KDM4E 500/4885
US-10889586-B2 Multi-kinase inhibitor compound, and crystal form and use thereof MAP2K5, MAP3K1, MAP3K7 RAB9A 1294/4885NPC1 3489/4885KDM4E 494/4885
US-20250082650-A1 COMBINED USE OF MULTIKINASE INHIBITOR PDCD1, CD274, PDCD1LG2 RAB9A 2171/4885NPC1 3745/4885KDM4E 708/4885
US-20190040064-A1 MULTI-KINASE INHIBITOR COMPOUND, AND CRYSTAL FORM AND USE THEREOF MAP2K5, MAP3K1, MAP3K7 RAB9A 1319/4885NPC1 3504/4885KDM4E 492/4885
US-10208042-B1 Multi-kinase inhibitor compound, and crystal form and use thereof MAP2K5, MAP3K1, MAP3K7 RAB9A 1294/4885NPC1 3489/4885KDM4E 494/4885
US-11718620-B2 Method for treating a cancer mediated by abnormality of multi-kinases MAP3K1, MAP3K5, MAP3K2 RAB9A 1316/4885NPC1 4184/4885KDM4E 784/4885

“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.