SCHEMBL10454502

SCHEMBL10454502

O=C(c1ccc(O[C@H]2CC[C@H](C(=O)O)C2)cc1Cl)c1cccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACSL1 P33121 6/20 0.43
▸ ACSL3 O95573 1/20 0.43
▸ ACSL6 Q9UKU0 1/20 0.43
▸ CDC25B P30305 2/20 0.40
▸ BCL2 P10415 1/20 0.40
▸ MCL1 Q07820 1/20 0.40
▸ BAD Q92934 1/20 0.40
▸ CNR2 P34972 5/20 0.37
▸ CNR1 P21554 4/20 0.37
▸ HRH1 P35367 4/20 0.37
▸ CCR3 P51677 4/20 0.37
▸ KCNH2 Q12809 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ NR4A1 P22736 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
SCHEMBL10454520 0.85 ACSL1 (0.43) ACSL1ACSL3ACSL6HRH1CCR3
SCHEMBL10455485 0.82 CNR2 (0.42) CDC25BCNR2CNR1MEN1KMT2A
SCHEMBL10454525 0.78 KMT2A (0.53) ACSL1ACSL3ACSL6KCNH2KMT2A
SCHEMBL10455661 0.76 S1PR5 (0.43) ACSL1ACSL3ACSL6CDC25BBCL2
SCHEMBL10455500 0.75 ACSL1 (0.41) ACSL1ACSL3ACSL6KCNH2
SCHEMBL10454526 0.75 GRIK1 (0.47) KCNH2
SCHEMBL10454523 0.75 MAPT (0.54) MEN1MAPTHTTKMT2ANPSR1
SCHEMBL10455645 0.73 BTK (0.41) —
SCHEMBL10455517 0.73 KMT2A (0.42) KMT2AL3MBTL1
SCHEMBL10455484 0.73 KMT2A (0.42) KMT2AL3MBTL1

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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