SCHEMBL10832017

SCHEMBL10832017

CC(CCNc1n[nH]c2ccccc12)N(C)C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.42
ADRA2A P08913 2/20 0.41
TRPA1 O75762 1/20 0.40
ACHE P22303 1/20 0.39
MAPK10 P53779 10/20 0.39
MAPK8 P45983 7/20 0.39
FADS1 O60427 2/20 0.38
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
KDM4E B2RXH2 1/20 0.37
PDPK1 O15530 1/20 0.37
CYP3A4 P08684 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL10831655 0.86 UTS2R (0.41) UTS2RADRA2ATRPA1ACHEMAPK10
SCHEMBL10831659 0.84 UTS2R (0.42) UTS2RADRA2ATRPA1ACHEMAPK10
SCHEMBL10369104 0.82 GSK3B (0.39) MAPK1KDM4E
SCHEMBL10368635 0.82 FADS1 (0.46) MAPK10MAPK8FADS1
SCHEMBL10831906 0.80 GAA (0.51) ADRA2ATRPA1ACHEGAA
SCHEMBL3243994 0.77 UTS2R (0.52) UTS2RADRA2ATRPA1ACHEMAPK10
SCHEMBL11087609 0.77 TOP2A (0.52) ADRA2AMAPK1KDM4EGAA
SCHEMBL10830998 0.77 UTS2R (0.40) UTS2RADRA2ATRPA1ACHEMAPK10
SCHEMBL10832205 0.76 MAPK10 (0.47) UTS2RACHEMAPK10MAPK8
SCHEMBL3104864 0.74 KDM4E (0.48) ADRA2ATRPA1ACHEMAPK10MAPK8

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-4585869-A ANTIINFLAMMATORY, ANALGESIC, ANTIULCER ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1986-04-29 US disclosed
US-4549023-A ANTINFLAMMATORY AGENTS, ANALGESICS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-10-22 US disclosed
EP-0049779-B1 3-AMINOINDAZOLE DERIVATIVES AND PROCESS FOR PREPARATION THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-10-31 EP disclosed
US-4474964-A 3-Aminoindazole derivatives ASAHI, KASEI, KOGYO, KABUSHIKI, KAISHA (JP) 1984-10-02 US disclosed
EP-0049779-A1 3-Aminoindazole derivatives and process for preparation thereof Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-04-21 EP disclosed