SCHEMBL17810294

SCHEMBL17810294

CCCCOCC(O)CNC(C)CC

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
HTT P42858 2/20 0.50
HPGD P15428 1/20 0.50
USP2 O75604 1/20 0.47
CASR P41180 1/20 0.43
HSD17B10 Q99714 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
LPAR5 Q9H1C0 1/20 0.41
KDM4E B2RXH2 2/20 0.40
SPHK1 Q9NYA1 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ADRB2 P07550 2/20 0.37
ADRB1 P08588 2/20 0.37

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
SCHEMBL11233623 0.87 HTT (0.56) POLBHTTHPGDUSP2CASR
SCHEMBL14362701 0.84 POLB (0.43) POLBHTTHPGDUSP2CASR
SCHEMBL17810313 0.84 POLB (0.49) POLBHTTHPGDUSP2CASR
SCHEMBL17810278 0.82 POLB (0.47) POLBHTTHPGDUSP2CASR
SCHEMBL11231094 0.81 HTT (0.66) POLBHTTHPGDUSP2CASR
SCHEMBL11340743 0.81 USP2 (0.58) HTTUSP2CASRHSD17B10CYP1A2
SCHEMBL23334641 0.79 USP2 (0.61) HTTUSP2CASRHSD17B10CYP1A2
SCHEMBL12441491 0.79 USP2 (0.61) HTTUSP2CASRHSD17B10CYP1A2
SCHEMBL20670848 0.79 USP2 (0.61) HTTUSP2CASRHSD17B10CYP1A2
SCHEMBL20670875 0.79 USP2 (0.61) HTTUSP2CASRHSD17B10CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160159660-A1 SILICON CONTAINING POLYMER FLOCCULANTS CYTEC INDUSTRIES INC. (US) 2016-06-09 US disclosed