SCHEMBL7700607

SCHEMBL7700607

CC(CNC(=O)c1ccc(-c2n[nH]c3c2Cc2ccccc2-3)cc1O)N1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 17/20 0.45
KDR P35968 3/20 0.43

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
SCHEMBL7091164 0.88 CHEK1 (0.50) CHEK1KDR
SCHEMBL7090796 0.85 CHEK1 (0.46) CHEK1KDR
SCHEMBL7704425 0.80 KDR (0.52) CHEK1KDR
SCHEMBL6999873 0.79 KDR (0.50) CHEK1KDR
SCHEMBL7096426 0.78 CHEK1 (0.54) CHEK1KDR
SCHEMBL7698827 0.73 CHEK1 (0.57) CHEK1KDR
SCHEMBL7094716 0.73 CHEK1 (0.51) CHEK1KDR
SCHEMBL7003703 0.72 KDR (0.55) CHEK1KDR
SCHEMBL7702171 0.72 CHEK1 (0.61) CHEK1KDR
SCHEMBL7704080 0.72 CHEK1 (0.48) CHEK1KDR

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 5 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
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
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