SCHEMBL5885134

SCHEMBL5885134

CCCCCCCCc1ccccc1N=C=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.49
CYP3A4 P08684 2/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
GABRA1 P14867 1/20 0.44
GABRB2 P47870 1/20 0.44
NR1H2 P55055 1/20 0.44
NR1H3 Q13133 1/20 0.44
BID P55957 3/20 0.42
MCL1 Q07820 3/20 0.42
BCL2L1 Q07817 2/20 0.42
BAK1 Q16611 2/20 0.42
KAT8 Q9H7Z6 2/20 0.42
PPARA Q07869 2/20 0.42
PPARG P37231 1/20 0.42
EP300 Q09472 1/20 0.42
KAT2A Q92830 1/20 0.42
KAT2B Q92831 1/20 0.42
KAT5 Q92993 1/20 0.42
SAE1 Q9UBE0 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
SCHEMBL2345792 1.00 LIPG (0.49) LIPGCYP3A4CYP2D6CYP2C9GABRA1
SCHEMBL5885469 1.00 LIPG (0.49) LIPGCYP3A4CYP2D6CYP2C9GABRA1
SCHEMBL13725696 1.00 LIPG (0.49) LIPGCYP3A4CYP2D6CYP2C9GABRA1
SCHEMBL29554576 1.00 LIPG (0.49) LIPGCYP3A4CYP2D6CYP2C9GABRA1
SCHEMBL5884676 1.00 LIPG (0.49) LIPGCYP3A4CYP2D6CYP2C9GABRA1
SCHEMBL10400982 1.00 LIPG (0.49) LIPGCYP3A4CYP2D6CYP2C9GABRA1
SCHEMBL5885574 1.00 LIPG (0.49) LIPGCYP3A4CYP2D6CYP2C9GABRA1
SCHEMBL5885474 1.00 LIPG (0.49) LIPGCYP3A4CYP2D6CYP2C9GABRA1
SCHEMBL5885360 1.00 LIPG (0.49) LIPGCYP3A4CYP2D6CYP2C9GABRA1
SCHEMBL2350176 0.98 CYP3A4 (0.46) LIPGCYP3A4CYP2D6CYP2C9GABRA1

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-9029482-B2 Method for preparing polycondensation resin CHEIL INDUSTRIES INC. (KR) 2015-05-12 US disclosed
US-20130165621-A1 Method for Preparing Polycondensation Resin CHEIL INDUSTRIES INC. (KR) 2013-06-27 US disclosed
US-7022257-B1 Coating composition and floor material coated with said composition SHIN-NAKAMURA CHEMICAL CO., LTD. (JP) 2006-04-04 US disclosed
US-20020175299-A1 Ultraviolet irradiation apparatus and method of forming cured coating film using the apparatus GEN MAINTENANCE TECHNOLOGY INC. (JP) 2002-11-28 US disclosed