SCHEMBL2463447

SCHEMBL2463447

Cc1cc(NC(N)=O)nc(=O)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
MAPT P10636 3/20 0.43
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
PSMD14 O00487 1/20 0.38
MMP2 P08253 1/20 0.38
LMNA P02545 4/20 0.37
POLB P06746 2/20 0.37
TP53 P04637 2/20 0.37
NR3C2 P08235 1/20 0.36
MAPK1 P28482 1/20 0.36
TSHR P16473 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
CYP3A4 P08684 1/20 0.35
PKM P14618 1/20 0.35
MAP4K1 Q92918 1/20 0.35

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
SCHEMBL29883731 0.81 MEN1 (0.41) KMT2AMEN1NPC1NR3C2MAPK1
SCHEMBL18358503 0.78 MAPT (0.48) KMT2AMAPTNPC1RAB9APSMD14
SCHEMBL8906196 0.76 MAPT (0.50) KMT2AMAPTNPC1RAB9APSMD14
SCHEMBL29972030 0.73 CCNA2 (0.58) KMT2AMEN1NPC1RAB9ATP53
SCHEMBL12462229 0.72 CYP3A4 (0.45) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL6508707 0.69 KMT2A (0.60) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL5186991 0.69 MEN1 (0.65) KMT2AMEN1POLBTP53
SCHEMBL513900 0.69 CYP3A4 (0.38) KMT2AMEN1NPC1NR3C2MAPK1
Urea SCHEMBL5444104 0.68 CYP3A4 (0.37) KMT2AMEN1NPC1NR3C2MAPK1
SCHEMBL1934832 0.67

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-9006364-B2 Supramolecular polymers from low-melting, easily processable building blocks SUPRAPOLIX B.V. (NL) 2015-04-14 US disclosed
US-20140142256-A1 SUPRAMOLECULAR POLYMERS FROM LOW-MELTING, EASILY PROCESSABLE BUILDING BLOCKS SUPRAPOLIX B.V. (NL) 2014-05-22 US disclosed
EP-2087027-B1 SUPRAMOLECULAR POLYMERS FROM LOW-MELTING, EASILY PROCESSABLE BUILDING BLOCKS SUPRAPOLIX BV (NL) 2011-10-05 EP disclosed
US-20100076147-A1 SUPRAMOLECULAR POLYMERS FROM LOW-MELTING, EASILY PROCESSABLE BUILDING BLOCKS SUPRAPOLIX B.V. (NL) 2010-03-25 US disclosed
EP-2087027-A2 SUPRAMOLECULAR POLYMERS FROM LOW-MELTING, EASILY PROCESSABLE BUILDING BLOCKS SupraPolix B.V. (NL) 2009-08-12 EP disclosed
WO-2008063057-A2 SUPRAMOLECULAR POLYMERS FROM LOW-MELTING, EASILY PROCESSABLE BUILDING BLOCKS SUPRAPOLIX B.V. (NL) 2008-05-29 WO disclosed