SCHEMBL20596003

SCHEMBL20596003

CCn1c(Cc2c(Cl)cc(Cl)cc2OC)cn(Cc2nc3nc(Cl)ccc3[nH]2)c1=O

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MARS2 Q96GW9 11/20 0.71
▸ CCNE2 O96020 6/20 0.33
▸ CCNE1 P24864 6/20 0.33
▸ CDK2 P24941 6/20 0.33
▸ CDK4 P11802 4/20 0.31
▸ CCND1 P24385 4/20 0.31
▸ FPR2 P25090 1/20 0.31
▸ CCNB2 O95067 3/20 0.31
▸ CDK1 P06493 3/20 0.31
▸ CCNB1 P14635 3/20 0.31
▸ CCNB3 Q8WWL7 3/20 0.31
▸ ADORA2B P29275 1/20 0.31
▸ P2RX7 Q99572 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
SCHEMBL23419412 0.86 MARS2 (0.53) MARS2CCNE2CCNE1CDK2CDK4
SCHEMBL20595910 0.86 MARS2 (0.80) MARS2FPR2
SCHEMBL20596040 0.83 MARS2 (1.00) MARS2
SCHEMBL20596125 0.82 MARS2 (1.00) MARS2FPR2P2RX7
SCHEMBL20595884 0.77 MARS2 (0.86) MARS2ADORA2B
SCHEMBL20595839 0.76 MARS2 (0.64) MARS2
SCHEMBL20595915 0.76 MARS2 (0.85) MARS2
SCHEMBL20595966 0.75 MARS2 (0.77) MARS2
SCHEMBL20595907 0.75 MARS2 (0.83) MARS2ADORA2B
SCHEMBL20596217 0.75 MARS2 (1.00) MARS2

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
WO-2018237349-A1 INHIBITORS OF TYPED 1 METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM UNIVERSITY OF WASHINGTON (US) 2018-12-27 — — WO claimed
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