SCHEMBL10686202

SCHEMBL10686202

O=C1N(Cc2ccccc2)c2ccccc2CC12CCCC2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
KMT2A Q03164 5/20 0.50
ALDH1A1 P00352 4/20 0.46
USP2 O75604 1/20 0.46
MAPT P10636 1/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ELANE P08246 3/20 0.44
MEN1 O00255 4/20 0.44
CYP1A2 P05177 1/20 0.43
GAA P10253 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SIGMAR1 Q99720 2/20 0.43
OPRM1 P35372 1/20 0.43
OPRK1 P41145 1/20 0.43
OPRL1 P41146 1/20 0.43
F2 P00734 1/20 0.42

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
SCHEMBL16163258 0.86 L3MBTL1 (0.51) KMT2AALDH1A1MAPTMEN1GAA
SCHEMBL30100711 0.80 L3MBTL1 (0.53) KMT2AALDH1A1MAPTMEN1GAA
SCHEMBL16163267 0.80 L3MBTL1 (0.53) KMT2AALDH1A1MAPTMEN1GAA
SCHEMBL29558351 0.71 GSK3A (0.65) POLBKMT2AALDH1A1MAPTELANE
SCHEMBL4791747 0.71 GSK3A (0.65) POLBKMT2AALDH1A1MAPTELANE
SCHEMBL578257 0.70 POLB (0.73) POLBKMT2AALDH1A1USP2MAPT
SCHEMBL31430235 0.70 NOTUM (0.41) POLBKMT2AALDH1A1MAPTMEN1
SCHEMBL30597487 0.70 POLB (0.73) POLBKMT2AALDH1A1USP2MAPT
SCHEMBL30905277 0.70 POLB (0.82) POLBKMT2AALDH1A1MAPTMEN1
SCHEMBL13309470 0.70 GSK3A (0.50) KMT2AALDH1A1ELANEMEN1CYP2C9

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-4738972-A Hypoglycemic thiazolidinediones PFIZER INC. (US) 1988-04-19 US disclosed