SCHEMBL3132997

SCHEMBL3132997

NCCCNCCN(CCCN)C(N)CCNCCN

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.41
CA6 P23280 5/20 0.41
CA7 P43166 5/20 0.41
CA9 Q16790 5/20 0.41
CA14 Q9ULX7 5/20 0.41
CA5B Q9Y2D0 5/20 0.41
CA2 P00918 4/20 0.41
CA4 P22748 4/20 0.41
CA5A P35218 4/20 0.41
ALOX15 P16050 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CASP2 P42575 2/20 0.41
F13A1 P00488 2/20 0.41
CYP1A2 P05177 2/20 0.41
THPO P40225 2/20 0.41
CYP2C19 P33261 2/20 0.41
RECQL P46063 2/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 3/20 0.41

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
SCHEMBL11236612 0.85 TDP1 (0.48) CA12CA6CA7CA9CA14
SCHEMBL8837096 0.77 CA12 (0.40) CA12CA6CA7CA9CA14
SCHEMBL11224974 0.76 GNAI3 (0.40) ALOX15MEN1KMT2ATDP1TSHR
SCHEMBL10506439 0.73 TDP1 (0.52) CA12CA6CA7CA9CA14
SCHEMBL11237797 0.71 TDP1 (0.37) CA12CA6CA7CA9CA14
SCHEMBL28058009 0.69 CA12 (0.60) CA12CA6CA7CA9CA14
SCHEMBL11228573 0.69 TDP1 (0.35) CA12CA6CA7CA9CA14
SCHEMBL2421695 0.69 DNM1 (0.35) MEN1KMT2ATSHRALDH1A1
SCHEMBL6251209 0.68 CA12 (0.86) CA12CA6CA7CA9CA14
Norspermidine SCHEMBL7943991 0.68 CA12 (0.86) CA12CA6CA7CA9CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2222777-A1 HALOGEN-FREE FLAME RETARDANT THERMOPLASTIC COMPOSITIONS SABIC Innovative Plastics IP B.V. (NL) 2010-09-01 EP disclosed
US-20100087573-A1 HALOGEN-FREE FLAME RETARDANT THERMOPLASTIC COMPOSITIONS SABIC INNOVATIVE PLASTICS IP B.V. (US) 2010-04-08 US disclosed
WO-2009081381-A1 HALOGEN-FREE FLAME RETARDANT THERMOPLASTIC COMPOSITIONS SABIC INNOVATIVE PLASTICS IP B.V. (US) 2009-07-02 WO disclosed
US-20060175587-A1 Reaction product of a phosphorous acid with ethyleneamines for flame resistance KASOWSKI MAYA M 2006-08-10 US disclosed
WO-2004078878-A1 REACTION PRODUCT OF A PHOSPHOROUS ACID WITH ETHYLENEAMINES FOR FLAME RESISTANCE KASOWSKI MAYA MELTZER (US) 2004-09-16 WO disclosed