SCHEMBL9370538

SCHEMBL9370538

CCCCCCC(=O)NCCCCCNc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.47
▸ EPHX2 P34913 1/20 0.45
▸ SPHK2 Q9NRA0 1/20 0.44
▸ SPHK1 Q9NYA1 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 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
SCHEMBL9375754 0.84 SOAT1 (0.47) HPGD
SCHEMBL9370118 0.82 SOAT2 (0.58) —
SCHEMBL9370785 0.82 SOAT2 (0.58) —
SCHEMBL9375339 0.79 SOAT2 (0.57) —
Biphenyl SCHEMBL27539378 0.74 HPGD (0.61) HPGDEPHX2
SCHEMBL7542456 0.72 NAAA (0.63) HPGDEPHX2
SCHEMBL27381884 0.69 HPGD (0.83) HPGDEPHX2KMT2A
SCHEMBL23775006 0.68 CASP2 (0.83) EPHX2
SCHEMBL20542645 0.68 CASP2 (0.83) EPHX2
SCHEMBL6424205 0.68 CASP2 (0.83) EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5318984-A Anticholesterol agents which inhibit acetyl coenzyme A transferase THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-06-07 — — US disclosed
EP-0372445-B1 Imidazoles for the treatment of atherosclerosis DU PONT MERCK PHARMA (US) 1994-03-09 — — EP disclosed
US-5166214-A Enzyme inhibitors for anticholesterol agents, enzyme inhibitor and cardiovascular disorders DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-11-24 — — US disclosed
WO-1991018885-A1 IMIDAZOLES FOR THE TREATMENT OF ATHEROSCLEROSIS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1991-12-12 — — WO disclosed
EP-0372445-A1 Imidazoles for the treatment of atherosclerosis THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1990-06-13 — — EP disclosed
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