SCHEMBL10455645

SCHEMBL10455645

O=C(c1ccccc1Cl)c1ccc(O[C@H]2CC[C@H](C(=O)O)C2)c(Cl)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 2/20 0.41
▸ RORC P51449 5/20 0.41
▸ RAB9A P51151 1/20 0.40
▸ GRIK1 P39086 8/20 0.39
▸ GRIA2 P42262 5/20 0.39
▸ S1PR5 Q9H228 1/20 0.38
▸ AKR1C3 P42330 1/20 0.37
▸ AKR1C1 Q04828 1/20 0.37
▸ PDE4A P27815 1/20 0.36
▸ PDE4B Q07343 1/20 0.36
▸ PDE4C Q08493 1/20 0.36
▸ PDE4D Q08499 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
SCHEMBL10455787 0.90 RORC (0.39) BTKRORCGRIK1GRIA2S1PR5
SCHEMBL10454493 0.90 RORC (0.43) BTKRORCGRIK1GRIA2S1PR5
SCHEMBL9765552 0.89 RORC (0.41) RORCGRIK1GRIA2S1PR5AKR1C3
SCHEMBL10455483 0.89 RORC (0.41) RORCGRIK1GRIA2S1PR5AKR1C3
SCHEMBL10455763 0.88 RORC (0.41) RORCGRIK1GRIA2S1PR5AKR1C3
SCHEMBL10455485 0.88 CNR2 (0.42) RORCRAB9AS1PR5
SCHEMBL10454526 0.88 GRIK1 (0.47) BTKRAB9AGRIK1GRIA2S1PR5
SCHEMBL10455774 0.84 P2RX7 (0.43) BTKRORCRAB9AGRIK1GRIA2
SCHEMBL10455761 0.84 P2RX7 (0.43) BTKRORCRAB9AGRIK1GRIA2
SCHEMBL10455519 0.84 P2RX7 (0.43) BTKRORCRAB9AGRIK1GRIA2

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-0210772-B1 3-[(4-Aroyl)phenoxy(or phenylthio)]cyclopentanecarboxylic acid analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1990-06-06 — — EP claimed
EP-0210772-A2 3-[(4-Aroyl)phenoxy(or phenylthio)]cyclopentanecarboxylic acid analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1987-02-04 — — 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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