SCHEMBL10454501

SCHEMBL10454501

Cc1ccc(C(=O)c2ccc(O[C@H]3CC[C@H](C(=O)O)C3)c(Cl)c2Cl)c(C)c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 7/20 0.44
▸ ACSL1 P33121 2/20 0.41
▸ GRIK1 P39086 4/20 0.41
▸ GRIA2 P42262 2/20 0.41
▸ CCR3 P51677 2/20 0.39
▸ PDE4A P27815 2/20 0.38
▸ PDE4B Q07343 2/20 0.38
▸ PDE4C Q08493 2/20 0.38
▸ PDE4D Q08499 2/20 0.38
▸ S1PR5 Q9H228 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.35
▸ UBE2N P61088 1/20 0.35

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
SCHEMBL10455777 0.89 CCR3 (0.44) RORCACSL1GRIK1GRIA2CCR3
SCHEMBL10454493 0.88 RORC (0.43) RORCACSL1GRIK1GRIA2PDE4A
SCHEMBL10454522 0.85 ACSL1 (0.48) RORCACSL1GRIK1GRIA2PDE4A
SCHEMBL10455645 0.82 BTK (0.41) RORCGRIK1GRIA2PDE4APDE4B
SCHEMBL10454495 0.81 RORC (0.40) RORCACSL1GRIK1GRIA2CCR3
SCHEMBL10454500 0.81 RORC (0.41) RORCPDE4APDE4BPDE4CPDE4D
SCHEMBL9765552 0.81 RORC (0.41) RORCACSL1GRIK1GRIA2PDE4A
SCHEMBL10455483 0.81 RORC (0.41) RORCACSL1GRIK1GRIA2PDE4A
SCHEMBL10455473 0.80 KMT2A (0.44) RORCGRIK1GRIA2PDE4APDE4B
SCHEMBL10455486 0.80 RORC (0.41) RORCACSL1GRIK1GRIA2CCR3

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 5 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
EP-0210772-A2 3-[(4-Aroyl)phenoxy(or phenylthio)]cyclopentanecarboxylic acid analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1987-02-04 — — EP disclosed
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