SCHEMBL7974415

SCHEMBL7974415

COCC1(Cc2cccc(OC(F)(F)F)c2)CCN(Cc2cnc(C)n2Cc2ccc(C#N)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 8/20 0.52
FNTB P49356 8/20 0.52
PGGT1B P53609 8/20 0.52
LMNA P02545 2/20 0.40
GPR6 P46095 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CNR1 P21554 2/20 0.37
TDP1 Q9NUW8 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP3A4 P08684 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP2C19 P33261 1/20 0.35
HSD17B10 Q99714 1/20 0.35
USP2 O75604 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 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
Hydrochloric Acid SCHEMBL7848662 0.99 FNTA (0.52) FNTAFNTBPGGT1BLMNAGPR6
SCHEMBL7840263 0.92 FNTA (0.53) FNTAFNTBPGGT1BLMNAMEN1
SCHEMBL7840048 0.90 FNTA (0.56) FNTAFNTBPGGT1BMEN1KMT2A
SCHEMBL7840536 0.88 FNTA (0.54) FNTAFNTBPGGT1BLMNAMEN1
Trifluoroacetic Acid SCHEMBL7850384 0.87 FNTA (0.56) FNTAFNTBPGGT1BGPR6MEN1
SCHEMBL7831376 0.86 FNTA (0.54) FNTAFNTBPGGT1BLMNAGPR6
SCHEMBL7839218 0.85 FNTA (0.65) FNTAFNTBPGGT1B
SCHEMBL7852114 0.85 FNTA (0.67) FNTAFNTBPGGT1BLMNAGPR6
Hydrochloric Acid SCHEMBL7840645 0.85 FNTA (0.66) FNTAFNTBPGGT1BLMNAGPR6
Hydrochloric Acid SCHEMBL7843273 0.85 FNTA (0.65) FNTAFNTBPGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6248756-B1 Inhibitors of farnesyl-protein transferase MERCK & CO., INC. 2001-06-19 US disclosed