SCHEMBL11153995

SCHEMBL11153995

CC(=O)CN(C(=O)c1ccco1)c1c(C)cccc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.48
LMNA P02545 4/20 0.44
S1PR4 O95977 1/20 0.44
ALDH1A1 P00352 4/20 0.44
GLA P06280 2/20 0.44
ATM Q13315 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
RAB9A P51151 1/20 0.44
MAPK1 P28482 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SIRT5 Q9NXA8 1/20 0.44
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 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
SCHEMBL11263111 0.87 OPRM1 (0.45) OPRM1LMNAS1PR4ALDH1A1GLA
SCHEMBL11147646 0.87 OPRM1 (0.45) OPRM1LMNAS1PR4ALDH1A1GLA
SCHEMBL11214373 0.84 LMNA (0.47) OPRM1LMNAS1PR4ALDH1A1GLA
SCHEMBL11264439 0.83 S1PR4 (0.44) OPRM1LMNAS1PR4ALDH1A1GLA
SCHEMBL11264436 0.83 S1PR4 (0.44) OPRM1LMNAS1PR4ALDH1A1GLA
SCHEMBL11145010 0.81 OPRM1 (0.44) OPRM1LMNAS1PR4ALDH1A1GLA
SCHEMBL11230355 0.81 OPRM1 (0.44) OPRM1LMNAS1PR4ALDH1A1GLA
SCHEMBL11151195 0.80 OPRM1 (0.43) OPRM1LMNAS1PR4ALDH1A1GLA
SCHEMBL11226941 0.79 OPRM1 (0.43) OPRM1LMNAS1PR4ALDH1A1GLA
SCHEMBL11229764 0.79 OPRM1 (0.43) OPRM1LMNAS1PR4ALDH1A1GLA

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
EP-0019858-B1 N-OXIMINOALKYL ANILIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES BAYER AG (DE) 1983-06-22 EP disclosed
US-4358477-A Process of curing unsaturated epoxy coating composition with radiation and epoxy curing agent, and coated substrate AKZO N.V. (NL) 1982-11-09 US disclosed
US-4337268-A MICROBIOCIDES BAYER AKTIENGESELLSCHAFT (DE) 1982-06-29 US disclosed
EP-0020859-A1 Substituted N-allyl acetanilides, process for their preparation and their use as fungicides BAYER AG (DE) 1981-01-07 EP disclosed
EP-0019858-A2 N-Oximinoalkyl anilides, process for their preparation and their use as fungicides BAYER AG (DE) 1980-12-10 EP disclosed