SCHEMBL3390203

SCHEMBL3390203

CCOc1n[nH]c(-c2ccccc2)c1-c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ GRM5 P41594 2/20 0.42
▸ MAPK14 Q16539 3/20 0.40
▸ RPS6KA3 P51812 1/20 0.40
▸ GCGR P47871 1/20 0.40
▸ NR1H2 P55055 1/20 0.39
▸ NR1H3 Q13133 1/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MAPK13 O15264 2/20 0.38
▸ MAPK12 P53778 2/20 0.38
▸ MAPK11 Q15759 2/20 0.38
▸ CYP1A2 P05177 2/20 0.38
▸ CNR1 P21554 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ GPR55 Q9Y2T6 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38

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
SCHEMBL3261776 0.91 MAPK1 (0.50) MAPK1NPSR1GRM5RPS6KA3MEN1
SCHEMBL3264021 0.78 HPGD (0.40) MEN1KMT2ACYP1A2KDM4EALDH1A1
SCHEMBL3260006 0.76 CHEK1 (0.56) MAPK1NPSR1MEN1KMT2ACNR1
SCHEMBL3260077 0.76 TTK (0.42) MAPK1NPSR1MEN1KMT2ACNR1
SCHEMBL12398406 0.75 NFKB1 (0.46) MAPK1NPSR1KMT2ACNR1CNR2
SCHEMBL6132076 0.73 MAPK1 (0.80) MAPK1NPSR1GRM5MAPK14RPS6KA3
SCHEMBL13495080 0.71 L3MBTL1 (0.55) MEN1KMT2ACNR1CNR2GPR55
SCHEMBL13495378 0.69 SMN1; SMN2 (0.52) NPSR1MEN1KMT2AKDM4EALDH1A1
SCHEMBL10355386 0.68 ALDH1A1 (0.44) MAPK14GCGRMEN1KMT2ACYP1A2
SCHEMBL3261016 0.67 KDM4E (0.43) MAPK1MAPK14GCGRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2151434-A1 Alkoxypyrazoles and the process for their preparation Institut Pasteur (FR) 2010-02-10 — — EP disclosed
EP-2151434-A1 Alkoxypyrazoles and the process for their preparation Institut Pasteur (FR) 2010-02-10 — — EP disclosed
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