SCHEMBL9012605

SCHEMBL9012605

c1ccc(/N=N/c2cccs2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
MEN1 O00255 7/20 0.43
KMT2A Q03164 7/20 0.43
MAPT P10636 5/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 2/20 0.43
PKM P14618 1/20 0.43
HTT P42858 1/20 0.43
NOS1 P29475 1/20 0.41
MAPK1 P28482 6/20 0.40
POLB P06746 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
TDP1 Q9NUW8 6/20 0.39
TSHR P16473 2/20 0.39
TRPA1 O75762 2/20 0.39
HSD17B10 Q99714 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 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
SCHEMBL8749028 1.00 ALDH1A1 (0.55) ALDH1A1MEN1KMT2AMAPTNPC1
SCHEMBL4758803 0.85 NPC1 (0.40) ALDH1A1MEN1KMT2AMAPTNPC1
SCHEMBL2167635 0.79 NOS1 (0.42) ALDH1A1MEN1KMT2AMAPTNPC1
Azobenzene SCHEMBL6562161 0.74 ALDH1A1 (1.00) ALDH1A1MEN1KMT2AMAPTNPC1
Azobenzene SCHEMBL32032 0.74 ALDH1A1 (1.00) ALDH1A1MEN1KMT2AMAPTNPC1
Azobenzene SCHEMBL6703357 0.74 ALDH1A1 (1.00) ALDH1A1MEN1KMT2AMAPTNPC1
Azobenzene SCHEMBL11124477 0.74 ALDH1A1 (1.00) ALDH1A1MEN1KMT2AMAPTNPC1
Azobenzene SCHEMBL11878769 0.74 ALDH1A1 (1.00) ALDH1A1MEN1KMT2AMAPTNPC1
Azobenzene SCHEMBL565791 0.74 ALDH1A1 (1.00) ALDH1A1MEN1KMT2AMAPTNPC1
Azobenzene SCHEMBL188378 0.74 ALDH1A1 (1.00) ALDH1A1MEN1KMT2AMAPTNPC1

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
US-5502170-A MONOAZO DYES FOR PRINTING TEXTILES SUCH AS POLYESTERS ANDCELLULOSE BASF AKTIENGESELLSCHAFT (DE) 1996-03-26 US disclosed
US-5502170-A MONOAZO DYES FOR PRINTING TEXTILES SUCH AS POLYESTERS ANDCELLULOSE BASF AKTIENGESELLSCHAFT (DE) 1996-03-26 US disclosed
US-5466790-A FOR DYEING OR PRINTING OF TEXTILE FIBERS BASF AKTIENGESELLSCHAFT (DE) 1995-11-14 US disclosed
US-5466790-A FOR DYEING OR PRINTING OF TEXTILE FIBERS BASF AKTIENGESELLSCHAFT (DE) 1995-11-14 US disclosed
WO-1993023479-A1 AZO DYES WITH AN ACETALISED DIAZO COMPONENT FROM THE THIOPHENE O R THIAZOL SERIES BASF AKTIENGESELLSCHAFT (DE) 1993-11-25 WO disclosed