SCHEMBL6994523

SCHEMBL6994523

Fc1ccc(CNc2ccc3c(c2)Cc2c(-c4ccccc4)n[nH]c2-3)cc1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 16/20 0.57
KDR P35968 3/20 0.56
PDGFRB P09619 1/20 0.49

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
SCHEMBL7704069 0.92 CHEK1 (0.54) CHEK1KDRPDGFRB
SCHEMBL7088880 0.90 CHEK1 (0.55) CHEK1KDRPDGFRB
SCHEMBL7095792 0.88 KDR (0.50) CHEK1KDRPDGFRB
SCHEMBL7701202 0.88 KDR (0.50) CHEK1KDRPDGFRB
SCHEMBL6998223 0.86 KDR (0.53) CHEK1KDRPDGFRB
SCHEMBL7696863 0.85 CHEK1 (0.52) CHEK1KDRPDGFRB
SCHEMBL7094479 0.84 KDR (0.50) CHEK1KDRPDGFRB
SCHEMBL6994516 0.81 KDR (0.51) CHEK1KDRPDGFRB
SCHEMBL7090906 0.79 KDM4E (0.55) CHEK1KDRPDGFRB
SCHEMBL7698823 0.77 CHEK1 (0.60) CHEK1KDRPDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1127051-A2 TRICYCLIC PYRAZOLE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2001-08-29 EP claimed
WO-2000027822-A2 TRICYCLIC PYRAZOLE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2000-05-18 WO claimed
EP-1289525-A2 TRICYCLIC PYRAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS Abbott GmbH & Co. KG (DE) 2003-03-12 EP disclosed
US-6462036-B1 INHIBITING SIGNAL TRANSDUCTION BY MODULATING ACTIVITY OF RECEPTOR AND NONRECEPTOR TYROSINE AND SERINE/THREONINE KINASES TO REGULATE AND MODULATE ABNORMAL OR INAPPROPRIATE CELL PROLIFERATION, DIFFERENTIATION, OR METABOLISM BASF AKTIENGESELLSCHAFT (DE) 2002-10-08 US disclosed
WO-2001087846-A2 TRICYCLIC PYRAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS ABBOTT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG & COMPANY KOMMANDITGESELLSCHAFT (DE) 2001-11-22 WO disclosed
EP-1127051-A2 TRICYCLIC PYRAZOLE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2001-08-29 EP disclosed
WO-2000027822-A2 TRICYCLIC PYRAZOLE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2000-05-18 WO disclosed