SCHEMBL7907180

SCHEMBL7907180

CCCOc1cccc(COCc2ccc(C(=O)OC)c(-c3ccccc3C)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 4/20 0.41
FNTB P49356 4/20 0.41
KAT6A Q92794 1/20 0.40
FFAR1 O14842 4/20 0.40
PPARD Q03181 1/20 0.40
FFAR4 Q5NUL3 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KMT2A Q03164 1/20 0.39
FAAH O00519 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP1A2 P05177 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
PLA2G4B P0C869 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
SCHEMBL7904993 0.90 KMT2A (0.46) FNTAFNTBKAT6AFFAR1PPARD
SCHEMBL7897520 0.83 FFAR1 (0.44) FNTAFNTBKAT6AFFAR1PPARD
SCHEMBL7910598 0.83 FNTA (0.43) FNTAFNTBFFAR1FFAR4
SCHEMBL7910498 0.81 FNTA (0.42) FNTAFNTBFFAR1FFAR4
SCHEMBL7907021 0.81 TDP1 (0.47) FNTAFNTBTDP1L3MBTL1KMT2A
SCHEMBL7897753 0.80 FNTA (0.67) FNTAFNTB
SCHEMBL7905941 0.80 FNTA (0.44) FNTAFNTBKMT2A
SCHEMBL7906344 0.79 FNTA (0.68) FNTAFNTB
SCHEMBL7906340 0.79 FNTA (0.68) FNTAFNTB
Lithium SCHEMBL7906212 0.79 FNTA (0.67) FNTAFNTB

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-6204293-B1 INHIBITING POST-TRANSLATIONAL MODIFICATION OF THE ONCOGENIC RAS PROTEIN BY PROTEIN FARNESYLTRANSFERASE, PROTEIN GERANYLGERANYLTRANSFERASE, OR BOTH UNIVERSITY OF PITTSBURGH 2001-03-20 US disclosed