SCHEMBL3465347

SCHEMBL3465347

Clc1ccnc2cn[nH]c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 3/20 0.47
TGFBR1 P36897 9/20 0.41
DAO P14920 1/20 0.40
CYP3A4 P08684 2/20 0.39
CYP2C8 P10632 2/20 0.39
HTT P42858 1/20 0.36
PTK2 Q05397 1/20 0.36
AXL P30530 1/20 0.34
PRKCI P41743 1/20 0.34
MAPK14 Q16539 4/20 0.34
NUDT1 P36639 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.32
TGFBR2 P37173 1/20 0.31
ABL2 P42684 1/20 0.31
CSNK1A1 P48729 1/20 0.31
CSNK1D P48730 1/20 0.31
MAP3K20 Q9NYL2 1/20 0.31
AURKA O14965 1/20 0.31
BRAF P15056 1/20 0.31

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
SCHEMBL19152664 0.75 HTT (0.45) TGFBR1CYP3A4CYP2C8HTTPTK2
SCHEMBL3466097 0.75 HTT (0.41) NOS1TGFBR1DAOCYP3A4CYP2C8
SCHEMBL2596969 0.75 NCF1 (0.41) TGFBR1CYP3A4CYP2C8HTTPTK2
SCHEMBL2598373 0.75 MAPKAPK2 (0.38) NOS1TGFBR1CYP3A4CYP2C8HTT
SCHEMBL29514304 0.75 NOS1 (0.47) NOS1TGFBR1DAOCYP3A4CYP2C8
SCHEMBL2598398 0.75 NOS1 (0.47) NOS1TGFBR1DAOCYP3A4CYP2C8
SCHEMBL9069902 0.74 NOS1 (0.47) NOS1TGFBR1DAOCYP3A4HTT
SCHEMBL14912053 0.73 AURKA (0.41) TGFBR1DAOPRKCIMAPK14POLB
SCHEMBL18237978 0.71 HTT (0.37) TGFBR1CYP3A4CYP2C8HTTPTK2
SCHEMBL20874628 0.71 KDM4E (0.46) TGFBR1HTTPTK2BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12522598-B2 3-(2-(heteroaryl)-pyridin-4-yl)-5-(trifluoromethyl)-1,2,4-oxadiazole derivatives as HDAC6 inhibitors ORYZON GENOMICS SA (ES) 2026-01-13 US disclosed
CN-120058798-A Bicyclic TEAD inhibitors 武汉人福创新药物研发中心有限公司 2025-05-30 CN disclosed
CN-120004864-A Bicyclic compounds, compositions comprising the same and uses thereof 贝达药业股份有限公司 2025-05-16 CN disclosed
US-20250074881-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2025-03-06 US disclosed
CN-114206868-B 3- (2- (Heteroaryl) -pyridin-4-yl) -5- (trifluoromethyl) -1,2, 4-oxadiazole derivatives as HDAC6 inhibitors 奥莱松基因组股份有限公司 2025-02-25 CN disclosed
US-20240360157-A1 TYK2 INHIBITORS BIOGEN MA INC. 2024-10-31 US disclosed
US-12110276-B2 Pyrazolo compounds and methods of use thereof GENENTECH, INC. (US) 2024-10-08 US disclosed
EP-4436957-A1 THERAPEUTIC INDAZOLE COMPOUNDS AND METHODS OF USE IN THE TREATMENT OF CANCER Genentech, Inc. (US) 2024-10-02 EP disclosed
CN-118302411-A Therapeutic indazole compounds and methods of use thereof for the treatment of cancer 基因泰克公司 2024-07-05 CN disclosed
US-20240209005-A1 BICYCLIC HETEROARYL BORONATE DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS RIBOSCIENCE LLC 2024-06-27 US disclosed
EP-1802621-A1 CRF RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO SB Pharmco Puerto Rico Inc. (PR) 2007-07-04 EP disclosed
WO-2006044821-A1 CRF RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO SB PHARMCO PUERTO RICO INC. (PR) 2006-04-27 WO disclosed
EP-0152910-B1 PYRAZOLOPYRIDINE DERIVATIVES BEECHAM GROUP PLC (GB) 1989-07-12 EP disclosed
EP-0119774-B1 ANTI-INFLAMMATORY PYRAZOLO PYRIDINES BEECHAM GROUP PLC (GB) 1987-06-24 EP disclosed
US-4670432-A Pyrazolopyridine derivatives useful in treating inflammation and allergic conditions BEECHAM GROUP P.L.C. (GB) 1987-06-02 US disclosed
US-4576952-A Pyrazolopyridine derivatives and their use as anti-inflammatory and/or anti-allergic agents BEECHAM GROUP P.L.C. (GB) 1986-03-18 US disclosed
US-4559348-A SKIN DISORDERS BEECHAM GROUP, P.L.C. (GB) 1985-12-17 US disclosed
EP-0152910-A2 pyrazolopyridine derivatives BEECHAM GROUP PLC (GB) 1985-08-28 EP disclosed
EP-0151962-A2 Pyrazolopyridine derivatives BEECHAM GROUP PLC (GB) 1985-08-21 EP disclosed
EP-0119774-A1 Anti-inflammatory pyrazolo pyridines BEECHAM GROUP PLC (GB) 1984-09-26 EP 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-20250074881-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE VHL, TP53, MCL1 NOS1 4130/4885TGFBR1 4882/4885DAO 3717/4885
US-20240209005-A1 BICYCLIC HETEROARYL BORONATE DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS ENPP1, ENPP3, ENTPD5 NOS1 1165/4885TGFBR1 3990/4885DAO 2139/4885
US-12110276-B2 Pyrazolo compounds and methods of use thereof THPO, KLK3, TP53 NOS1 2879/4885TGFBR1 4873/4885DAO 1817/4885
US-20240360157-A1 TYK2 INHIBITORS TYK2, JAK2, ABL1 NOS1 4540/4885TGFBR1 1048/4885DAO 1826/4885

“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.