SCHEMBL10455809

SCHEMBL10455809

O=C(c1ccc(O[C@H]2CC[C@H](C(=O)O)C2)cc1)c1c(Cl)cccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 8/20 0.43
▸ ELANE P08246 2/20 0.43
▸ DGAT1 O75907 4/20 0.41
▸ FAAH O00519 2/20 0.40
▸ RORC P51449 1/20 0.39
▸ ACSL1 P33121 2/20 0.39
▸ OPRK1 P41145 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ PARP10 Q53GL7 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ SENP8 Q96LD8 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ ACSL3 O95573 1/20 0.38
▸ ACSL6 Q9UKU0 1/20 0.38
▸ POLB P06746 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
SCHEMBL10455484 0.88 KMT2A (0.42) EPHX2ELANEDGAT1FAAHRORC
SCHEMBL10455517 0.88 KMT2A (0.42) EPHX2ELANEDGAT1FAAHRORC
SCHEMBL10454525 0.87 KMT2A (0.53) EPHX2ELANEDGAT1FAAHACSL1
SCHEMBL10455781 0.86 ELANE (0.57) EPHX2ELANEDGAT1FAAHACSL1
SCHEMBL10455806 0.85 ELANE (0.45) EPHX2ELANEFAAHALDH1A1POLB
SCHEMBL10455500 0.82 ACSL1 (0.41) EPHX2ELANEDGAT1FAAHRORC
SCHEMBL10454523 0.82 MAPT (0.54) EPHX2FAAHCASP3TDP1POLB
SCHEMBL10455653 0.80 ELANE (0.45) EPHX2ELANEDGAT1FAAHALDH1A1
SCHEMBL10454520 0.80 ACSL1 (0.43) ELANEACSL1KCNH2ALDH1A1LMNA
SCHEMBL26857799 0.80 AKR1C3 (0.51) EPHX2DGAT1ACSL1ACSL3ACSL6

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 3 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-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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