SCHEMBL8300440

SCHEMBL8300440

O=C(O)C=C1CCc2cc(Cl)ccc2C1=O

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SRD5A1 P18405 1/20 0.53
▸ SRD5A2 P31213 1/20 0.53
▸ MIF P14174 8/20 0.49
▸ MAOB P27338 4/20 0.49
▸ CYP26A1 O43174 3/20 0.48
▸ CYP19A1 P11511 3/20 0.44
▸ CYP11B1 P15538 2/20 0.44
▸ CYP11B2 P19099 2/20 0.44
▸ METAP1 P53582 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ MAOA P21397 1/20 0.43

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
SCHEMBL23273172 0.91 SRD5A1 (0.47) SRD5A1SRD5A2MIFMAOBCYP26A1
SCHEMBL9390050 0.89 SRD5A1 (0.57) SRD5A1SRD5A2MIFMAOBCYP26A1
SCHEMBL9390046 0.89 SRD5A1 (0.57) SRD5A1SRD5A2MIFMAOBCYP26A1
SCHEMBL9390039 0.89 SRD5A1 (0.57) SRD5A1SRD5A2MIFMAOBCYP26A1
SCHEMBL17195434 0.82 MIF (0.53) MIFMAOBCYP26A1METAP1MAOA
SCHEMBL14564405 0.82 MIF (0.53) MIFMAOBCYP26A1METAP1MAOA
SCHEMBL14061927 0.79 MIF (0.65) MIFCYP26A1CYP19A1HTT
SCHEMBL14137061 0.79 MIF (0.65) MIFCYP26A1CYP19A1HTT
SCHEMBL4975289 0.79 MIF (0.65) MIFCYP26A1CYP19A1HTT
SCHEMBL2601324 0.78 METAP1 (0.60) SRD5A1SRD5A2MIFCYP26A1CYP19A1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0478195-B1 Dihydropyridazinones and pyridazinones as fungicides ROHM & HAAS (US) 1999-05-26 — — EP disclosed
US-5753642-A AGRICULTURE, MEDICINE ROHM AND HAAS COMPANY (US) 1998-05-19 — — US disclosed
US-5728698-A AGRICULTURAL USE, RICE, WHEAT ROHM AND HAAS COMPANY (US) 1998-03-17 — — US disclosed
US-5728715-A FOR MAMMALS, AGRICULTURE, RICE, WHEAT, TOMATOES ROHM AND HAAS COMPANY (US) 1998-03-17 — — US disclosed
US-5728694-A Dihydropyridazinones, pyridazinones and related compounds as fungicides ROHM AND HAAS COMPANY (US) 1998-03-17 — — US disclosed
US-5726162-A FOR CONTROLLING AGRICULTURAL AND MAMMALIAN FUNGAL DISEASES ROHM AND HAAS COMPANY (US) 1998-03-10 — — US disclosed
US-5726176-A FOR CONTROLLING AGRICULTURAL AND MAMMALIAN FUNGAL DISEASES ROHM AND HAAS COMPANY (US) 1998-03-10 — — US disclosed
US-5631254-A RICE; HUMAN INFECTIONS ROHM AND HAAS COMPANY (US) 1997-05-20 — — US disclosed
US-5552409-A PHYTOPATHOGENIC, RICE ROHM AND HAAS COMPANY (US) 1996-09-03 — — US disclosed
EP-0478195-A1 Dihydropyridazinones, pyridazinones and related compounds as fungicides ROHM AND HAAS COMPANY (US) 1992-04-01 — — EP disclosed
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