SCHEMBL13320344

SCHEMBL13320344

CCC(C)(C)CCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.51
MEN1 O00255 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
KMT2A Q03164 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
SCHEMBL10655528 0.85 CHRM2 (0.53) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL12362807 0.84 CHRM2 (0.56) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL6387770 0.81 TDP1 (0.50) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL12933270 0.79 TDP1 (0.56) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL799700 0.79 CHRM2 (0.58) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL8967791 0.79 MAPT (0.51) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL4579773 0.78 TDP1 (0.51) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL149620 0.78 CHRM2 (0.61) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL29511230 0.78 CHRM2 (0.61) CHRM2MEN1CYP1A2CYP2C19KMT2A
SCHEMBL24060310 0.78 TDP1 (0.54) CHRM2MEN1CYP1A2CYP2C19KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8569420-B2 Singly-terminated polyisobutylenes and process for making same THE UNIVERSITY OF AKRON (US) 2013-10-29 US disclosed
US-8552118-B2 Polyisobutylenes and process for making same THE UNIVERSITY OF AKRON (US) 2013-10-08 US disclosed
US-20110082259-A1 SINGLY-TERMINATED POLYISOBUTYLENES AND PROCESS FOR MAKING SAME THE UNIVERSITY OF AKRON (US) 2011-04-07 US disclosed
US-20100130696-A1 POLYISOBUTYLENES AND PROCESS FOR MAKING SAME THE UNIVERSITY OF AKRON (US) 2010-05-27 US disclosed