SCHEMBL172843

SCHEMBL172843

Cc1cc(C)cc(N=N)c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
TSHR P16473 2/20 0.40
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
C1S P09871 1/20 0.36
PRSS3 P35030 1/20 0.36
ACHE P22303 2/20 0.33
TPMT P51580 1/20 0.32
SELL P14151 1/20 0.30
SELP P16109 1/20 0.30
SELE P16581 1/20 0.30
HTR3E A5X5Y0 1/20 0.30
HTR3B O95264 1/20 0.30
HTR3A P46098 1/20 0.30
HTR3D Q70Z44 1/20 0.30
HTR3C Q8WXA8 1/20 0.30

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
SCHEMBL24422400 0.77 NOS1 (0.35)
SCHEMBL13701496 0.75 CYP1A2 (0.35) TSHR
SCHEMBL11695348 0.73 ALDH1A1 (0.44) ALDH1A1TSHRPRSS1PRSS2C1S
SCHEMBL1672267 0.73 ALDH1A1 (0.44) ALDH1A1TSHRPRSS1PRSS2C1S
SCHEMBL10815192 0.73 ALDH1A1 (0.44) ALDH1A1TSHRPRSS1PRSS2C1S
SCHEMBL28566447 0.73 ALDH1A1 (0.53) ALDH1A1TSHRPRSS1PRSS2C1S
SCHEMBL172578 0.73
SCHEMBL16659632 0.71 ALDH1A1 (0.37) ALDH1A1TSHRACHE
SCHEMBL26115 0.71
SCHEMBL341533 0.71 ALDH1A1 (0.67) ALDH1A1TSHRPRSS1PRSS2C1S

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
EP-1521125-B1 Electrophotographic photoconductor, electrophotographic method, electrophotographic apparatus, process cartridge for electrophotographic apparatus and azo compound RICOH CO LTD (JP) 2012-03-07 EP disclosed