SCHEMBL9736039

SCHEMBL9736039

O=C1C2=C(CCCC2)C(=O)N1c1ccc(Cl)c(OCc2ccccc2)c1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 1/20 0.46
▸ GRM5 P41594 2/20 0.45
▸ JAK2 O60674 1/20 0.43
▸ ZAP70 P43403 1/20 0.43
▸ PPOX P50336 3/20 0.42
▸ HPGD P15428 2/20 0.41
▸ RXRA P19793 1/20 0.41
▸ RXRB P28702 1/20 0.41
▸ BCL2A1 Q16548 1/20 0.41
▸ MRGPRX4 Q96LA9 1/20 0.40
▸ PTGER1 P34995 1/20 0.40

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
SCHEMBL11381647 0.80 PPOX (0.52) PPOX
SCHEMBL11067532 0.80 PPOX (0.40) PPOX
SCHEMBL11062108 0.80 PPOX (0.40) PPOX
SCHEMBL11058197 0.79 PPOX (0.39) PPOX
SCHEMBL9781318 0.79 PPOX (0.51) PPOX
SCHEMBL11375981 0.79 PPOX (0.39) PPOX
SCHEMBL11013820 0.79 PPOX (0.39) PPOX
SCHEMBL11186280 0.79 PPOX (0.41) JAK2ZAP70PPOXHPGDPTGER1
SCHEMBL5610349 0.78 NOTUM (0.46) NOTUMHPGDRXRARXRBMRGPRX4
SCHEMBL11410268 0.78 JAK2 (0.48) JAK2ZAP70PPOXHPGDPTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2083368-A — — None — — JP disclosed
JP-55139359-A — — None — — JP disclosed
US-5169428-A Tetrahydrophthalimide derivative and herbicide composition containing same TOSOH CORPORATION (JP) 1992-12-08 — — US disclosed
JP-H0283368-A TETRAHYDROPHTHALIMIDE DERIVATIVE AND HERBICIDE CONTAINING THE SAME DERIVATIVE AS ACTIVE INGREDIENT TOSOH CORP 1990-03-23 — — JP disclosed
EP-0323271-A1 Tetrahydrophthalimide derivative and herbicide composition containing the same Tosoh Corporation (JP) 1989-07-05 — — EP disclosed
US-4292070-A N-Substituted tetrahydrophthalimide and herbicidal composition MITSUBISHI CHEMICAL INDUSTRIES, LTD. (JP) 1981-09-29 — — US disclosed
JP-S55139359-A TETRAHYDROPHTHALIMIDES, AND HERBICIDE CONTAINING COMPOUND AS EFFECTIVE COMPONENT MITSUBISHI CHEM IND LTD 1980-10-31 — — JP disclosed
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