SCHEMBL10455456

SCHEMBL10455456

O=C(c1ccccc1)c1ccc(O[C@H]2CC[C@H](C(=O)O)C2)c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.44
▸ MAPT P10636 3/20 0.43
▸ HPGD P15428 1/20 0.43
▸ LMNA P02545 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ S1PR5 Q9H228 2/20 0.41
▸ CDC25B P30305 1/20 0.39
▸ AKR1C3 P42330 1/20 0.38
▸ AKR1C1 Q04828 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ ELANE P08246 1/20 0.38
▸ HTR6 P50406 1/20 0.38
▸ PDE5A O76074 1/20 0.38
▸ PDE4A P27815 1/20 0.37
▸ PDE4B Q07343 1/20 0.37
▸ PDE4C Q08493 1/20 0.37

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
SCHEMBL10455483 0.84 RORC (0.41) MAPTS1PR5AKR1C3AKR1C1KDM4E
SCHEMBL9765552 0.84 RORC (0.41) MAPTS1PR5AKR1C3AKR1C1KDM4E
SCHEMBL10455506 0.84 S1PR5 (0.40) KMT2AMAPTLMNAHTTNPSR1
SCHEMBL9765584 0.79 POLB (0.41) KMT2AMAPTHPGDLMNA
SCHEMBL9765589 0.79 POLB (0.41) KMT2AMAPTHPGDLMNA
SCHEMBL10454503 0.77 OPRM1 (0.47) MAPTHPGDLMNAHTTNPSR1
SCHEMBL10454524 0.77 EPHX2 (0.44) HPGDS1PR5ELANEPDE4APDE4B
SCHEMBL10455485 0.76 CNR2 (0.42) KMT2AS1PR5CDC25BRORC
SCHEMBL10455781 0.76 ELANE (0.57) LMNAAKR1C3AKR1C1ELANEACSL3
SCHEMBL10454520 0.76 ACSL1 (0.43) KMT2AMAPTHPGDLMNAHTT

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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