SCHEMBL7700850

SCHEMBL7700850

CCCCCNC(=O)CCN

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.70
NAAA Q02083 1/20 0.66
SLC6A5 Q9Y345 2/20 0.63
HPGD P15428 1/20 0.57
FAAH O00519 3/20 0.56
EPHX1 P07099 4/20 0.54
DPP7 Q9UHL4 1/20 0.53
DNM1 Q05193 1/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
EPHX2 P34913 2/20 0.51
RRM1 P23921 1/20 0.51

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
SCHEMBL17817620 0.98 CASP2 (0.74) CASP2NAAASLC6A5HPGDFAAH
SCHEMBL27836368 0.98 CASP2 (0.74) CASP2NAAASLC6A5HPGDFAAH
SCHEMBL28688783 0.98 CASP2 (0.74) CASP2NAAASLC6A5HPGDFAAH
SCHEMBL11739321 0.98 CASP2 (0.74) CASP2NAAASLC6A5HPGDFAAH
SCHEMBL13019125 0.98 CASP2 (0.74) CASP2NAAASLC6A5HPGDFAAH
SCHEMBL24412649 0.98 CASP2 (0.74) CASP2NAAASLC6A5HPGDFAAH
Hydrochloric Acid SCHEMBL20542987 0.96 CASP2 (0.71) CASP2NAAASLC6A5HPGDFAAH
Hydrochloric Acid SCHEMBL23000981 0.96 CASP2 (0.71) CASP2NAAASLC6A5HPGDFAAH
SCHEMBL3550215 0.94 CASP2 (0.61) CASP2NAAASLC6A5HPGDFAAH
SCHEMBL22522082 0.92 SLC6A5 (0.64) CASP2NAAASLC6A5HPGDFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233209-B1 COSMETIC METHOD FOR CONTROLLING ODORS OREAL (FR) 2019-03-27 EP disclosed
EP-2090323-B1 Hyperbranched polymer conjugates via non-enzymatic cleavable linker ASCENDIS PHARMA GROWTH DISORDERS DIVISION AS (DK) 2016-07-27 EP disclosed
WO-2002079172-A1 METHOD FOR PREPARING MONOCYCLIC $I(N)-ACYL-AMINOLACTAM COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-10-10 WO disclosed
US-5614519-A (1-(2,3 or 4-N-morpholinoalkyl)-imidazol-4-yl)-benizimidazol-1-yl-methyl]-biphenyls useful as angiotensin-II antagonists KARL THOMAE GMBH (DE) 1997-03-25 US disclosed
US-5602127-A ADMINISTERING TO TREAT HYPERTENSION KARL THOMAE GMBH (DE) 1997-02-11 US disclosed
US-5594003-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-14 US disclosed