SCHEMBL860788

SCHEMBL860788

CCc1cc2cccc(O)c2nc1C

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.76
MEN1 O00255 1/20 0.76
KDM4E B2RXH2 5/20 0.49
METAP2 P50579 2/20 0.49
PLAU P00749 1/20 0.41
NCF1 P14598 1/20 0.41
DAO P14920 1/20 0.41
PDE10A Q9Y233 2/20 0.40
PIM1 P11309 1/20 0.40
PDE4D Q08499 1/20 0.40
GRM1 Q13255 1/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40
HIF1A Q16665 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL30938970 0.82 MEN1 (0.61) KMT2AMEN1KDM4EMETAP2ALDH1A1
SCHEMBL15845269 0.81 KMT2A (0.55) KMT2AMEN1KDM4EMETAP2PLAU
SCHEMBL1232234 0.80 KMT2A (0.66) KMT2AMEN1KDM4EMETAP2PLAU
SCHEMBL15119498 0.79 MEN1 (0.53) KMT2AMEN1KDM4EMETAP2DAO
SCHEMBL3112677 0.78 KMT2A (0.64) KMT2AMEN1KDM4EMETAP2PLAU
SCHEMBL29432255 0.78 KMT2A (0.64) KMT2AMEN1KDM4EMETAP2PLAU
Methane SCHEMBL9370413 0.77 KMT2A (0.62) KMT2AMEN1KDM4EMETAP2PLAU
SCHEMBL30318916 0.77 KMT2A (0.62) KMT2AMEN1KDM4EMETAP2PLAU
SCHEMBL8755649 0.76 METAP2 (0.53) KMT2AMEN1KDM4EMETAP2PLAU
Diethylamine SCHEMBL7880811 0.76 MEN1 (0.56) KMT2AMEN1KDM4EMETAP2PLAU

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
EP-1970413-B1 Silicone composition and a paper treatment agent comprising the same SHINETSU CHEMICAL CO (JP) 2012-03-28 EP disclosed
EP-2135899-A1 Silicone composition and a paper treatment agent comprising the same Shinetsu Chemical Co., Ltd. (JP) 2009-12-23 EP disclosed
EP-1441009-B1 Silicone composition and a paper treatment agent comprising the same SHINETSU CHEMICAL CO (JP) 2009-09-30 EP disclosed
US-7459213-B2 Silicone composition and a paper treatment agent comprising the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2008-12-02 US disclosed
EP-1970413-A1 Silicone composition and a paper treatment agent comprising the same Shin-Etsu Chemical Co., Ltd. (JP) 2008-09-17 EP disclosed
US-20080064814-A1 SILICONE COMPOSITION AND A PAPER TREATMENT AGENT COMPRISING THE SAME YAMAMOTO KENJI 2008-03-13 US disclosed
US-20070032596-A1 Silicone composition and a paper treatment agent comprising the same YAMAMOTO KENJI 2007-02-08 US disclosed
US-20040152825-A1 Silicone composition and a paper treatment agent comprising the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2004-08-05 US disclosed
EP-1441009-A1 Silicone composition and a paper treatment agent comprising the same Shin-Etsu Chemical Co., Ltd. (JP) 2004-07-28 EP disclosed