SCHEMBL8499498

SCHEMBL8499498

Fc1cccc(-c2cnc3cccc(-c4ccsc4)c3c2)c1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 9/20 0.65
PDGFRA P16234 9/20 0.65
CDK8 P49336 1/20 0.47
MAP4K4 O95819 1/20 0.43
TOP1 P11387 1/20 0.43
MAPK10 P53779 2/20 0.41
NT5E P21589 1/20 0.40
SSTR2 P30874 1/20 0.40
CYP2E1 P05181 1/20 0.40
CYP2A6 P11509 1/20 0.40
CYP2B6 P20813 1/20 0.40
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39
PIK3CA P42336 1/20 0.39

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
SCHEMBL31060894 0.79 PDGFRB (1.00) PDGFRBPDGFRACDK8CYP2E1CYP2A6
SCHEMBL8501434 0.79 PDGFRB (1.00) PDGFRBPDGFRACDK8CYP2E1CYP2A6
SCHEMBL8502173 0.78 PDGFRB (0.63) PDGFRBPDGFRAMAP4K4TOP1CYP2E1
SCHEMBL8499486 0.77 PDGFRB (0.74) PDGFRBPDGFRAMAP4K4TOP1CYP2E1
SCHEMBL3238945 0.76 CYP2A6 (0.56) PDGFRBPDGFRACYP2E1CYP2A6CYP2B6
SCHEMBL30172705 0.76 CYP2A6 (0.56) PDGFRBPDGFRACYP2E1CYP2A6CYP2B6
SCHEMBL8887276 0.74 CHEK2 (0.53) MAP4K4MAPK10NT5ESSTR2
SCHEMBL8503296 0.72 MAP4K4 (0.47) MAP4K4NT5E
SCHEMBL26259994 0.69 CYP2A6 (0.52) PDGFRBPDGFRACDK8CYP2E1CYP2A6
SCHEMBL12074839 0.69 FYN (0.53) PDGFRBPDGFRA

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
US-5646153-A INHIBITING ABNORMAL CELL PROLIFERATION RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-08 US claimed
US-RE36256-E ADMINISTERING ARYL-SUBSTITUTED QUINOXALINE DERIVATIVES AS ANTIPROLIFERATIVE, ANTICARCINOGENIC AND ANTITUMOR AGENTS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-07-20 US disclosed
US-5795889-A INHIBITING CELL GROWTH WITH ENZYME INHIBITORS FOR SKIN DISORDERS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-08-18 US disclosed
US-5646153-A INHIBITING ABNORMAL CELL PROLIFERATION RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-08 US disclosed
US-5480883-A Bis mono- and bicyclic aryl and heteroaryl compounds which inhibit EGF and/or PDGF receptor tyrosine kinase RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-01-02 US disclosed