Cyclopentanol

Cyclopentanol

SCHEMBL11345162

C=C(C)C(=O)Cl.C=C(C)C(=O)OC1CCCC1.OC1CCCC1

nearest known ligand 0.34

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Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.34
TSHR P16473 1/20 0.33
NAAA Q02083 2/20 0.33
ALDH1A1 P00352 2/20 0.32
HTT P42858 1/20 0.31
GPR35 Q9HC97 2/20 0.31
CYP19A1 P11511 1/20 0.30

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
SCHEMBL1491253 0.90 ALDH1A1 (0.37) EPHX1TSHRNAAAALDH1A1HTT
SCHEMBL10645478 0.86 EPHX1 (0.42) EPHX1TSHRNAAAALDH1A1HTT
SCHEMBL36619 0.86 EPHX1 (0.42) EPHX1TSHRNAAAALDH1A1HTT
SCHEMBL201767 0.86 EPHX1 (0.42) EPHX1TSHRNAAAALDH1A1HTT
SCHEMBL22480 0.84 EPHX1 (0.46) EPHX1NAAAALDH1A1HTTGPR35
SCHEMBL887989 0.84 EPHX1 (0.46) EPHX1NAAAALDH1A1HTTGPR35
SCHEMBL16297135 0.84 EPHX1 (0.46) EPHX1NAAAALDH1A1HTTGPR35
SCHEMBL18822970 0.84 EPHX1 (0.46) EPHX1NAAAALDH1A1HTTGPR35
SCHEMBL1052594 0.84 EPHX1 (0.46) EPHX1NAAAALDH1A1HTTGPR35
SCHEMBL28878275 0.84 EPHX1 (0.46) EPHX1NAAAALDH1A1HTTGPR35

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-4258204-A REACTING ALPHA, BETA-UNSATURATED ORGANIC ACID HALIDE WITH ALCOHOL IN PRESENCE OF MOLECULAR SIEVE UNIVERSITY PATENTS, INC. (US) 1981-03-24 US disclosed