SCHEMBL8191925

SCHEMBL8191925

CC(C(Cc1ccc(C#Cc2ccccc2)cc1)c1ccc(Cl)cc1)N(C)c1ccc2ccccc2c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 9/20 0.42
CNR2 P34972 6/20 0.42
ACACB O00763 4/20 0.40
PTGES O14684 1/20 0.37
TPH1 P17752 1/20 0.36
ASIC3 Q9UHC3 1/20 0.36
UTS2R Q9UKP6 2/20 0.35

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
SCHEMBL8624864 0.88 FDFT1 (0.43) CNR1CNR2PTGESTPH1UTS2R
SCHEMBL8619447 0.88 UTS2R (0.43) CNR1CNR2TPH1UTS2R
SCHEMBL8125412 0.85 PIN1 (0.39) UTS2R
SCHEMBL8623160 0.82 UTS2R (0.42) UTS2R
SCHEMBL8623018 0.81 FDFT1 (0.35) CNR1CNR2TPH1UTS2R
SCHEMBL8623571 0.80 FDFT1 (0.40) CNR1CNR2
SCHEMBL8621420 0.80 UTS2R (0.45) CNR1UTS2R
SCHEMBL8200288 0.80 RELA (0.36) CNR1CNR2UTS2R
SCHEMBL8792831 0.79 SIGMAR1 (0.43) UTS2R
SCHEMBL8621717 0.79 TPH1 (0.44) PTGESTPH1UTS2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6017956-A AN ANTITUMOR AGENT, AN ENZYME INHIBITOR FOR INHIBITING PROTEIN-FARNESYL TRANSFERASE TO SUPPRESS FUNCTION OF ONCOGENE PROTEIN RAS BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-01-25 US disclosed
US-5919786-A ANTITUMOR AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-07-06 US disclosed
US-5849747-A N, n-disubstituted amic acid derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-12-15 US disclosed
EP-0805154-A1 N,N-DISUBSTITUTED AMIC ACID DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 1997-11-05 EP disclosed