SCHEMBL10455653

SCHEMBL10455653

O=C(c1ccc(O[C@H]2CC[C@H](C(=O)O)C2)cc1)c1cccc(F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.45
▸ KMT2A Q03164 2/20 0.44
▸ EPHX2 P34913 5/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ HPGD P15428 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ FFAR4 Q5NUL3 1/20 0.41
▸ DGAT1 O75907 2/20 0.41
▸ FAAH O00519 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ GRM5 P41594 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39

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
SCHEMBL10455781 0.87 ELANE (0.57) ELANEEPHX2ALDH1A1LMNAFFAR4
SCHEMBL10455806 0.86 ELANE (0.45) ELANEKMT2AEPHX2ALDH1A1MEN1
SCHEMBL10455655 0.81 AR (0.42) KMT2ALMNASMN1; SMN2GRM5
SCHEMBL10455809 0.80 EPHX2 (0.43) ELANEEPHX2ALDH1A1LMNADGAT1
SCHEMBL10454504 0.80 ELANE (0.43) ELANEKMT2AEPHX2ALDH1A1DGAT1
SCHEMBL10454503 0.80 OPRM1 (0.47) ELANEALDH1A1HPGDLMNAMAPT
SCHEMBL10455651 0.79 ACSL1 (0.43) ELANEEPHX2ALDH1A1HPGDLMNA
SCHEMBL28596195 0.77 ELANE (0.71) ELANEKMT2AALDH1A1HPGDMEN1
SCHEMBL10455517 0.76 KMT2A (0.42) ELANEKMT2AEPHX2ALDH1A1TSHR
SCHEMBL10455484 0.76 KMT2A (0.42) ELANEKMT2AEPHX2ALDH1A1TSHR

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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