SCHEMBL7743587

SCHEMBL7743587

O=C(ON1CCc2c(Br)cccc2C1)C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 9/20 0.55
AKR1C3 P42330 1/20 0.42
CARM1 Q86X55 2/20 0.39
PRMT6 Q96LA8 1/20 0.39
PRMT1 Q99873 1/20 0.39
ACACB O00763 5/20 0.39
S1PR5 Q9H228 1/20 0.36
UCHL1 P09936 1/20 0.35
TRAP1 Q12931 1/20 0.34

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
SCHEMBL2300549 0.79 ABHD6 (0.47) ABHD6CARM1ACACBS1PR5
SCHEMBL7738243 0.77 ABHD6 (0.54) ABHD6AKR1C3CARM1
SCHEMBL772680 0.77 ABHD6 (0.69) ABHD6AKR1C3CARM1PRMT6PRMT1
SCHEMBL7737943 0.73 CARM1 (0.39) ABHD6CARM1S1PR5
SCHEMBL7744239 0.73 NR1H3 (0.36) ABHD6S1PR5
SCHEMBL7744238 0.73 NR1H3 (0.36) ABHD6S1PR5
SCHEMBL29163080 0.73 ABHD6 (0.36) ABHD6UCHL1
SCHEMBL3716227 0.72 TRPM8 (0.56) ABHD6
SCHEMBL2119725 0.71 ABHD6 (0.65) ABHD6UCHL1
SCHEMBL29421744 0.71 ABHD6 (0.65) ABHD6UCHL1

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
EP-1045843-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-10-24 EP disclosed
EP-1045843-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2000-10-25 EP disclosed
US-5977134-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-11-02 US disclosed
WO-1999028313-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1999-06-10 WO disclosed