SCHEMBL9166295

SCHEMBL9166295

O=C1CCCC1Cc1ccc(F)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 9/20 0.56
PTGS1 P23219 7/20 0.56
OPRK1 P41145 1/20 0.56
HTT P42858 1/20 0.56
KMT2A Q03164 1/20 0.56
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA4 P22748 2/20 0.44
CA6 P23280 2/20 0.44

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
SCHEMBL5517558 0.96 PTGS2 (0.52) PTGS2PTGS1OPRK1HTTKMT2A
SCHEMBL11794283 0.95 PTGS2 (0.51) PTGS2PTGS1OPRK1HTTKMT2A
SCHEMBL29169558 0.82 PTGS2 (0.56) PTGS2PTGS1OPRK1HTTKMT2A
SCHEMBL22211304 0.82 PTGS2 (0.56) PTGS2PTGS1OPRK1HTTKMT2A
SCHEMBL29169517 0.82 PTGS2 (0.60) PTGS2PTGS1OPRK1HTTKMT2A
SCHEMBL2760385 0.82 PTGS2 (0.60) PTGS2PTGS1OPRK1HTTKMT2A
SCHEMBL12645998 0.82 PTGS2 (0.56) PTGS2PTGS1OPRK1HTTKMT2A
SCHEMBL1784163 0.82 PTGS2 (0.56) PTGS2PTGS1OPRK1HTTKMT2A
SCHEMBL2049346 0.82 PTGS2 (0.56) PTGS2PTGS1OPRK1HTTKMT2A
SCHEMBL4557085 0.82 PTGS2 (0.60) PTGS2PTGS1OPRK1HTTKMT2A

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
CN-103596942-A Azole derivative, process for producing azole derivative, and intermediate compound KUREHA CORP 2014-02-19 CN disclosed
EP-0571267-B1 Use of azole derivatives for the preparation of drugs useful for inhibiting the aromatase and treating of estrogen-dependent diseases KUREHA CHEMICAL IND CO LTD (JP) 1995-04-26 EP disclosed
US-5286737-A Benzyl, cyclopentane azole derivatives KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1994-02-15 US disclosed
EP-0571267-A1 Use of azole derivatives for the preparation of drugs useful for inhibiting the aromatase and treating of estrogen-dependent diseases KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1993-11-24 EP disclosed