SCHEMBL11060237

SCHEMBL11060237

Brc1cc(-c2ccccc2)cc(Br)c1NN=NNc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
RAB9A P51151 5/20 0.44
NPC1 O15118 3/20 0.44
CASP3 P42574 2/20 0.44
SENP8 Q96LD8 2/20 0.44
SENP7 Q9BQF6 2/20 0.44
SENP6 Q9GZR1 2/20 0.44
CYP1A1 P04798 2/20 0.42
CYP1B1 Q16678 2/20 0.42
TSHR P16473 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
AKR1C4 P17516 1/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
AKR1C1 Q04828 1/20 0.39
MAPT P10636 5/20 0.36
GAA P10253 3/20 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
SCHEMBL809342 0.78 TDP1 (0.54) MEN1KMT2ARAB9ANPC1CASP3
SCHEMBL10494615 0.76 MGLL (0.52) MEN1KMT2ARAB9ANPC1CASP3
Hydrochloric Acid SCHEMBL2382822 0.76 TDP1 (0.52) MEN1KMT2ARAB9ANPC1CASP3
SCHEMBL9055960 0.74 TDP1 (0.67) MEN1KMT2ARAB9ANPC1CASP3
SCHEMBL29662848 0.68 APEX1 (0.67) CRHBPCRHR2RAB9ANPC1TDP1
SCHEMBL22717286 0.66 CRHBP (0.62) CRHBPCRHR2RAB9ANPC1TDP1
SCHEMBL3535836 0.65 TSHR (0.45) MEN1KMT2ARAB9ANPC1CASP3
SCHEMBL23568147 0.65 CRHBP (0.60) CRHBPCRHR2MEN1KMT2ATSHR
SCHEMBL7842844 0.65 CRHBP (1.00) CRHBPCRHR2MEN1KMT2ATSHR
SCHEMBL28879617 0.65 CRHBP (0.60) CRHBPCRHR2RAB9ANPC1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4424156-A Halo-substituted amino-and substituted-sulphonamido-containing azo dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1984-01-03 US disclosed