SCHEMBL122167

SCHEMBL122167

Cn1cnc2ccccc2c1=O

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACVR1 Q04771 2/20 0.61
IP6K1 Q92551 1/20 0.58
KDM4E B2RXH2 2/20 0.54
HPGD P15428 1/20 0.54
HSD17B10 Q99714 1/20 0.54
USP5 P45974 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
GAA P10253 1/20 0.53
PKM P14618 1/20 0.53
TSHR P16473 1/20 0.53
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPC1 O15118 1/20 0.49
POLB P06746 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 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
SCHEMBL29723028 1.00 ACVR1 (0.61) ACVR1IP6K1KDM4EHPGDHSD17B10
SCHEMBL29608405 0.85 ACVR1 (0.49) ACVR1IP6K1KDM4EHPGDHSD17B10
SCHEMBL6921434 0.78 IP6K1 (0.52) ACVR1IP6K1KDM4EL3MBTL1
SCHEMBL3636921 0.78 RAB9A (0.57) KDM4EHPGDHSD17B10USP5GAA
SCHEMBL19049515 0.77 LMNA (0.61) RAB9ASMN1; SMN2POLBCYP1A2CYP2D6
SCHEMBL22021641 0.76 KDM4E (0.54) KDM4EHPGDHSD17B10USP5GAA
SCHEMBL16181504 0.76 KDM4E (0.54) KDM4EHPGDHSD17B10USP5GAA
SCHEMBL6972582 0.76 KDM4E (0.54) KDM4EHPGDHSD17B10USP5GAA
SCHEMBL30743619 0.76 KDM4E (0.54) KDM4EHPGDHSD17B10USP5L3MBTL1
SCHEMBL258690 0.76 KDM4E (0.54) KDM4EHPGDHSD17B10USP5GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11845745-B2 Tri-substituted imidazoles for the inhibition of TGF beta and methods of treatment Clavius Pharmaceuticals, LLC. (US) 2023-12-19 US claimed
US-20220073514-A1 TRI-SUBSTITUTED IMIDAZOLES FOR THE INHIBITION OF TGF BETA AND METHODS OF TREATMENT Clavius Pharmaceuticals, LLC. 2022-03-10 US claimed
US-11124509-B2 Tri-substituted imidazoles for the inhibition of TGF beta and methods of treatment Clavius Pharmaceuticals, LLC. (US) 2021-09-21 US claimed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP claimed
WO-2025067168-A1 AZA FUSED RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 苏州爱科百发生物医药技术有限公司 2025-04-03 WO disclosed
US-12077548-B2 Substituted imidazoles for the inhibition of TGF-β and methods of treatment Clavius Pharmaceuticals, LLC. (US) 2024-09-03 US disclosed
EP-3854799-B1 CYCLIC DINUCLEOTIDE ANALOGUE, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATION SHANGHAI DE NOVO PHARMATECH CO LTD (CN) 2024-07-17 EP disclosed
CN-117946012-A Preparation method of nitrogen-containing heterocycle 温州理工学院 2024-04-30 CN disclosed
WO-2024006956-A9 DEUBIQUITINASE INHIBITORS AND METHODS OF USE THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-04-11 WO disclosed
CN-111757876-B DNA-PK inhibitors 沃泰克斯药物股份有限公司 2024-03-22 CN disclosed
WO-2024020221-A1 MODULATORS OF TYK2 PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2024-01-25 WO disclosed
US-11845745-B2 Tri-substituted imidazoles for the inhibition of TGF beta and methods of treatment Clavius Pharmaceuticals, LLC. (US) 2023-12-19 US disclosed
WO-2003076438-A1 PIPERAZINYL-, PIPERIDINYL- AND MORPHOLINYL-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2003-09-18 WO disclosed
WO-2003076395-A1 CARBONYLAMINO-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2003-09-18 WO disclosed
WO-2003076401-A1 SULFONYLAMINO-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2003-09-18 WO disclosed
WO-2003076400-A1 NEW INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2003-09-18 WO disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed
WO-2003024450-A1 METHODS FOR TREATING PRION DISEASES EISAI CO., LTD. (JP) 2003-03-27 WO disclosed
WO-2003024456-A1 METHODS FOR TREATING AND PREVENTING MIGRAINES EISAI CO., LTD. (JP) 2003-03-27 WO disclosed
CN-1356983-A Tri-aryl acid derivatives as PPAR receptor ligands AVENTIS PHARM PROD INC (DE) 2002-07-03 CN 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 (4 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-12077548-B2 Substituted imidazoles for the inhibition of TGF-β and methods of treatment TGFB1, TGFBR1, TGFB2 ACVR1 25/4885IP6K1 324/4885KDM4E 1077/4885
US-11124509-B2 Tri-substituted imidazoles for the inhibition of TGF beta and methods of treatment TGFB1, TGFBR1, TGFB2 ACVR1 7/4885IP6K1 959/4885KDM4E 1460/4885
US-20220073514-A1 TRI-SUBSTITUTED IMIDAZOLES FOR THE INHIBITION OF TGF BETA AND METHODS OF TREATMENT TGFB1, TGFBR1, TGFB2 ACVR1 7/4885IP6K1 959/4885KDM4E 1460/4885
US-11845745-B2 Tri-substituted imidazoles for the inhibition of TGF beta and methods of treatment TGFB1, TGFBR1, TGFB2 ACVR1 7/4885IP6K1 959/4885KDM4E 1460/4885

“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.