SCHEMBL7784441

SCHEMBL7784441

CCCCCCNC(=O)n1ccc(=O)[nH]c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ASAH1 Q13510 3/20 0.61
LMNA P02545 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2D6 P10635 1/20 0.61
MAPK3 P27361 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
SQOR Q9Y6N5 1/20 0.61

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
SCHEMBL11668643 0.88 ASAH1 (0.46) ASAH1LMNACYP3A4CYP2D6MAPK3
SCHEMBL15598464 0.82 ASAH1 (0.48) ASAH1
SCHEMBL15538910 0.82 ASAH1 (0.54) ASAH1
SCHEMBL15537994 0.80 ASAH1 (0.55) ASAH1
SCHEMBL15537792 0.80 ASAH1 (0.49) ASAH1LMNACYP3A4CYP2D6MAPK3
SCHEMBL15538622 0.79 CA1 (0.41) ASAH1
SCHEMBL15538164 0.78 ASAH1 (0.50) ASAH1LMNACYP3A4CYP2D6MAPK3
SCHEMBL15538693 0.77 ASAH1 (0.71) ASAH1LMNACYP3A4CYP2D6MAPK3
SCHEMBL15538170 0.77 MLYCD (0.41)
SCHEMBL15539115 0.77 NAMPT (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-55019245-A None JP disclosed
EP-2875006-A1 ACID CERAMIDASE INHIBITORS AND THEIR USE AS MEDICAMENTS Fondazione Istituto Italiano Di Tecnologia (IT) 2015-05-27 EP disclosed
WO-2013178576-A1 ACID CERAMIDASE INHIBITORS AND THEIR USE AS MEDICAMENTS FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2013-12-05 WO disclosed
JP-2001064179-A ANTICANCER AGENT INCLUDING CARBAMOYL DERIVATIVE AS ACTIVE INGREDIENT MITSUI CHEMICALS INC 2001-03-13 JP disclosed
US-4650801-A CYTOSINE TO INHIBIT DECOMPOSITION TAIHO PHARMACEUTICAL COMPANY, LTD. (JP) 1987-03-17 US disclosed
EP-0068268-B1 ENHANCER OF ANTI-TUMOUR EFFECT Yamasa Shoyu Kabushiki Kaisha (JP) 1985-05-02 EP disclosed
EP-0048022-B1 ENHANCER OF ANTI-TUMOR EFFECT Yamasa Shoyu Kabushiki Kaisha (JP) 1985-01-09 EP disclosed
EP-0079054-A1 Enhancer of antitumor effect Yamasa Shoyu Kabushiki Kaisha (JP) 1983-05-18 EP disclosed
JP-S5519245-A ANTI-MALIGNANT TUMOR AGENT COMPOSITION TAIHO YAKUHIN KOGYO KK 1980-02-09 JP disclosed