SCHEMBL9345356

SCHEMBL9345356

O=[N+]([O-])c1cc(Cl)c(/N=N/c2ccc(N(CCO)CCO)cc2)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.56
KMT2A Q03164 7/20 0.56
MEN1 O00255 6/20 0.56
TDP1 Q9NUW8 3/20 0.56
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
NPSR1 Q6W5P4 2/20 0.56
HSP90AA1 P07900 1/20 0.56
MAPK1 P28482 1/20 0.56
RECQL P46063 1/20 0.56
ALDH1A1 P00352 8/20 0.48
GAA P10253 4/20 0.48
POLB P06746 3/20 0.48
MMP14 P50281 1/20 0.41
TSHR P16473 1/20 0.41
GPR35 Q9HC97 1/20 0.38
PSMD14 O00487 1/20 0.38
MITF O75030 1/20 0.38
HTT P42858 4/20 0.36
VCAM1 P19320 1/20 0.36

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
SCHEMBL9345361 1.00 MAPT (0.56) MAPTKMT2AMEN1TDP1NPC1
SCHEMBL11434684 0.93 MAPT (0.52) MAPTKMT2AMEN1TDP1NPC1
SCHEMBL16222316 0.91 MAPT (0.48) MAPTKMT2AMEN1TDP1NPC1
SCHEMBL11587917 0.88 MEN1 (0.54) MAPTKMT2AMEN1TDP1NPC1
SCHEMBL11587913 0.88 MEN1 (0.54) MAPTKMT2AMEN1TDP1NPC1
SCHEMBL5053748 0.85 KMT2A (0.42) MAPTKMT2AMEN1TDP1NPC1
SCHEMBL5313232 0.85 MAPT (0.49) MAPTKMT2AMEN1TDP1NPC1
SCHEMBL8947507 0.85 KMT2A (0.42) MAPTKMT2AMEN1TDP1NPC1
SCHEMBL5313230 0.85 MAPT (0.49) MAPTKMT2AMEN1TDP1NPC1
SCHEMBL29558709 0.85 KMT2A (0.42) MAPTKMT2AMEN1TDP1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0605566-A1 LIGHT-ABSORBING POLYURETHANE COMPOSITIONS AND THERMOPLASTIC POLYMERS COLORED THEREWITH EASTMAN CHEMICAL COMPANY (US) 1994-07-13 EP disclosed
WO-1993006147-A1 LIGHT-ABSORBING POLYURETHANE COMPOSITIONS AND THERMOPLASTIC POLYMERS COLORED THEREWITH EASTMAN KODAK COMPANY (US) 1993-04-01 WO disclosed
US-5194463-A LIGHT-ABSORBING POLYURETHANE COMPOSITIONS AND THERMOPLASTIC POLYMERS COLORED THEREWITH EASTMAN KODAK COMPANY (US) 1993-03-16 US disclosed