SCHEMBL7904965

SCHEMBL7904965

COC(=O)c1ccc(COCCCCCc2cccc(Cl)c2)cc1-c1ccccc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAOB P27338 1/20 0.38
MAPT P10636 2/20 0.38
SLC6A5 Q9Y345 1/20 0.38
POLB P06746 1/20 0.38
HSP90AA1 P07900 1/20 0.38
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
NPC1 O15118 2/20 0.37
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
THRB P10828 1/20 0.37
RAB9A P51151 1/20 0.37
FNTA P49354 2/20 0.37
FNTB P49356 2/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37

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
SCHEMBL7906935 0.90 FFAR1 (0.44) FFAR1FFAR4L3MBTL1TDP1MAOB
SCHEMBL7907021 0.89 TDP1 (0.47) L3MBTL1TDP1ALDH1A1RAB9AFNTA
SCHEMBL7906343 0.82 FNTA (0.62) FNTAFNTB
SCHEMBL7907129 0.81 FNTA (0.61) FNTAFNTB
SCHEMBL7906995 0.80 TDP1 (0.50) FFAR1FFAR4L3MBTL1TDP1RAB9A
Lithium Ion SCHEMBL7910333 0.79 FNTA (0.64) FNTAFNTB
SCHEMBL7910598 0.78 FNTA (0.43) FFAR1FFAR4FNTAFNTBSLC6A4
SCHEMBL7905941 0.75 FNTA (0.44) FNTAFNTBSLC6A4SLC6A3
SCHEMBL7907180 0.75 FNTA (0.41) FFAR1FFAR4L3MBTL1TDP1MAPT
SCHEMBL7904963 0.73 SLC6A4 (0.37) NPC1ALDH1A1SMN1; SMN2FNTAFNTB

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