SCHEMBL1878464

SCHEMBL1878464

NC(N)(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 5/20 0.52
MAPT P10636 3/20 0.46
TSHR P16473 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP3A4 P08684 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
POLB P06746 1/20 0.46
PARP1 P09874 1/20 0.46
RECQL P46063 1/20 0.46
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46
HSD17B10 Q99714 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CES2 O00748 2/20 0.44
DAO P14920 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
KCNN4 O15554 1/20 0.44
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL461653 0.80 CES1 (0.50) CES1MAPTTSHRCYP2C19CYP3A4
SCHEMBL10887738 0.78 CES1 (0.53) CES1MAPTTSHRCYP2C19CYP3A4
SCHEMBL4719207 0.78 CES1 (0.48) CES1MAPTTSHRCYP2C19CYP3A4
SCHEMBL622048 0.78 CYP1A2 (0.54) MAPTTSHRCYP2C19CYP3A4TDP1
SCHEMBL669434 0.78 CES1 (0.58) CES1MAPTTSHRCYP2C19CYP3A4
SCHEMBL28341721 0.77 CES1 (0.52) CES1MAPTTSHRCYP2C19CYP3A4
SCHEMBL1476483 0.77 CES1 (0.56) CES1MAPTTSHRCYP2C19CYP3A4
SCHEMBL1817734 0.76 MAPT (0.58) MAPTTSHRCYP2C19CYP3A4TDP1
SCHEMBL15519395 0.76 CES1 (0.56) CES1MAPTTSHRCYP2C19CYP3A4
SCHEMBL1666976 0.76 CES1 (0.61) CES1MAPTTSHRCYP2C19CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9822205-B2 Deoxybenzoin-derived anti-flammable polymers UNIVERSITY OF MASSACHUSETTS (US) 2017-11-21 US disclosed
US-9340635-B2 Deoxybenzoin-derived anti-flammable polymers UNIVERSITY OF MASSACHUSETTS (US) 2016-05-17 US disclosed
US-20160009854-A1 DEOXYBENZOIN-DERIVED ANTI-FLAMMABLE POLYMERS UNIVERSITY OF MASSACHUSETTS 2016-01-14 US disclosed
US-20160009841-A1 DEOXYBENZOIN-DERIVED ANTI-FLAMMABLE POLYMERS UNIVERSITY OF MASSACHUSETTS 2016-01-14 US disclosed
US-9175131-B2 Deoxybenzoin-derived anti-flammable polymers UNIVERSITY OF MASSACHUSETTS (US) 2015-11-03 US disclosed
US-20130102754-A1 DEOXYBENZOIN-DERIVED ANTI-FLAMMABLE POLYMERS UNIVERSITY OF MASSACHUSETTS (US) 2013-04-25 US disclosed
US-8314202-B2 Deoxybenzoin-derived anti-flammable polymers UNIVERSITY OF MASSACHUSETTS (US) 2012-11-20 US disclosed
US-20110112241-A1 DEOXYBENZOIN-DERIVED ANTI-FLAMMABLE POLYMERS UNIVERSITY OF MASSACHUSETTS 2011-05-12 US disclosed
WO-2009123969-A2 DEOXYBENZOIN-DERIVED ANTI-FLAMMABLE POLYMERS UNIVERSITY OF MASSACHUSETTS (US) 2009-10-08 WO disclosed