SCHEMBL3382194

SCHEMBL3382194

C1CNCN1.OCCN1CCNC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
CXCR4 P61073 2/20 0.35
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.32
POLB P06746 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CHRM5 P08912 1/20 0.31
CHRM3 P20309 1/20 0.31

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
SCHEMBL415783 0.91
Hydrochloric Acid SCHEMBL16486635 0.89
SCHEMBL7683711 0.80 CXCR4 (0.52) MAPTKMT2ACXCR4KDM4EALDH1A1
SCHEMBL13014195 0.80 CXCR4 (0.52) MAPTKMT2ACXCR4KDM4EALDH1A1
Piperazine SCHEMBL27519110 0.80 CXCR4 (0.52) MAPTKMT2ACXCR4KDM4EALDH1A1
SCHEMBL4425028 0.78
SCHEMBL6222124 0.78
SCHEMBL12958864 0.78 CXCR4 (0.50) MAPTKMT2ACXCR4KDM4EALDH1A1
Piperazine SCHEMBL28279894 0.78 CXCR4 (0.50) MAPTKMT2ACXCR4KDM4EALDH1A1
SCHEMBL361682 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142853-A1 NOVEL PHENOLIC RESINS SWEDO RAYMOND J (US) 2012-06-07 US disclosed
EP-1751199-B1 NOVEL PHENOLIC RESINS ANGUS CHEMICAL (US) 2010-11-24 EP disclosed
US-7319131-B2 Phenolic resins ANGUS CHEMICAL COMPANY (US) 2008-01-15 US disclosed
EP-1751199-A1 NOVEL PHENOLIC RESINS ANGUS CHEMICAL COMPANY (US) 2007-02-14 EP disclosed
WO-2005108453-A1 NOVEL PHENOLIC RESINS ANGUS CHEMICAL COMPANY (US) 2005-11-17 WO disclosed
US-20050054787-A1 Novel phenolic resins ANGUS CHEMICAL COMPANY 2005-03-10 US disclosed