SCHEMBL7918130

SCHEMBL7918130

COCC1CCC(Cc2ccccc2)N1C(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CETP P11597 4/20 0.48
NR1H2 P55055 2/20 0.43
NR1H3 Q13133 2/20 0.43
KLK7 P49862 2/20 0.42
STS P08842 1/20 0.42
ABCB1 P08183 2/20 0.41
GPR119 Q8TDV5 2/20 0.41
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
KLK5 Q9Y337 1/20 0.40
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL7918131 1.00 CETP (0.48) CETPNR1H2NR1H3KLK7STS
SCHEMBL5457099 0.88 ABCB1 (0.42) CETPKLK7STSABCB1GPR119
SCHEMBL14592644 0.88 ABCB1 (0.42) CETPKLK7STSABCB1GPR119
SCHEMBL7908527 0.87 CETP (0.47) CETPNR1H2NR1H3KLK7STS
SCHEMBL7908533 0.87 CETP (0.47) CETPNR1H2NR1H3KLK7STS
SCHEMBL18711884 0.81 CETP (0.42) CETPNR1H2NR1H3KLK7STS
SCHEMBL31642777 0.80 ABCB1 (0.41) CETPKLK7STSABCB1GPR119
SCHEMBL14592659 0.78 CHRM2 (0.44) CETPNR1H2ABCB1
SCHEMBL2433744 0.78 CHRM2 (0.44) CETPNR1H2ABCB1
SCHEMBL27379482 0.78 CHRM2 (0.44) CETPNR1H2

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-6221865-B1 INHIBITORS OF PROTEIN FARNESYLTRANSFERASE AND PROTEIN GERANYLGERANYLTRANSFERASE. UNIVERSITY OF PITTSBURGH 2001-04-24 US disclosed