SCHEMBL10455810

SCHEMBL10455810

O=C(c1ccccc1O[C@H]1CC[C@H](C(=O)O)C1)c1c(Cl)cccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 4/20 0.43
▸ GRIA2 P42262 4/20 0.43
▸ EPHX2 P34913 2/20 0.42
▸ KCNH2 Q12809 2/20 0.40
▸ RAB9A P51151 1/20 0.39
▸ AKR1C3 P42330 1/20 0.38
▸ AKR1C1 Q04828 1/20 0.38
▸ SLC6A4 P31645 2/20 0.38
▸ SLC6A2 P23975 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.38
▸ KAT2B Q92831 1/20 0.37
▸ BAZ2B Q9UIF8 1/20 0.37
▸ FFAR4 Q5NUL3 1/20 0.37
▸ S1PR5 Q9H228 2/20 0.37
▸ RORC P51449 1/20 0.36
▸ OPRK1 P41145 1/20 0.36

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
SCHEMBL10454526 0.90 GRIK1 (0.47) GRIK1GRIA2EPHX2KCNH2RAB9A
SCHEMBL10455761 0.89 P2RX7 (0.43) GRIK1GRIA2EPHX2KCNH2RAB9A
SCHEMBL10455519 0.89 P2RX7 (0.43) GRIK1GRIA2EPHX2KCNH2RAB9A
SCHEMBL10455774 0.89 P2RX7 (0.43) GRIK1GRIA2EPHX2KCNH2RAB9A
SCHEMBL10455763 0.85 RORC (0.41) GRIK1GRIA2AKR1C3AKR1C1S1PR5
SCHEMBL10455807 0.83 GRIK1 (0.41) GRIK1GRIA2
SCHEMBL10454505 0.81 GRIK1 (0.44) GRIK1GRIA2EPHX2KCNH2RAB9A
SCHEMBL10455805 0.81 S1PR5 (0.42) GRIK1GRIA2EPHX2KCNH2AKR1C3
SCHEMBL10455809 0.80 EPHX2 (0.43) EPHX2KCNH2RORCOPRK1
SCHEMBL10455655 0.79 AR (0.42) GRIK1GRIA2RAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0210772-B1 3-[(4-Aroyl)phenoxy(or phenylthio)]cyclopentanecarboxylic acid analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1990-06-06 — — EP claimed
EP-0210772-B1 3-[(4-Aroyl)phenoxy(or phenylthio)]cyclopentanecarboxylic acid analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1990-06-06 — — EP disclosed
US-4916147-A 3-[(4-Aroyl) phenoxy (or phenylthio)]-cyclopentanecarboxylic acid analogues and treatment of cerebral edema therewith ONO PHARMACEUTICAL CO., LTD. (JP) 1990-04-10 — — US disclosed
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