SCHEMBL30668486

SCHEMBL30668486

COc1cc(F)c(F)c2c1NC(=O)C(C)(C)N2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MOGAT2 Q3SYC2 5/20 0.38
▸ ADAMTS4 O75173 3/20 0.32
▸ ADAMTS5 Q9UNA0 3/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ AKR1B1 P15121 1/20 0.31
▸ TUBB1 Q9H4B7 1/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ CDK2 P24941 1/20 0.30
▸ MAP3K11 Q16584 1/20 0.30
▸ GRIN2D O15399 1/20 0.30
▸ GRIN3B O60391 1/20 0.30
▸ GRIN1 Q05586 1/20 0.30
▸ GRIN2A Q12879 1/20 0.30
▸ GRIN2B Q13224 1/20 0.30
▸ GRIN2C Q14957 1/20 0.30
▸ GRIN3A Q8TCU5 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
SCHEMBL21624379 1.00 MOGAT2 (0.38) MOGAT2ADAMTS4ADAMTS5ALDH1A1KDM4E
SCHEMBL21624329 0.81 ALDH1A1 (0.33) ALDH1A1TUBB1
SCHEMBL30668465 0.81 ALDH1A1 (0.33) ALDH1A1TUBB1
SCHEMBL21624340 0.79 ALDH1A1 (0.39) MOGAT2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL30006137 0.79 ALDH1A1 (0.39) MOGAT2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL21624351 0.79 MOGAT2 (0.40) MOGAT2AKR1B1
SCHEMBL30006081 0.79 MOGAT2 (0.40) MOGAT2AKR1B1
SCHEMBL23648075 0.76 ALDH1A1 (0.39) MOGAT2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL21624366 0.75 MOGAT2 (0.43) MOGAT2AKR1B1
SCHEMBL30668483 0.75 MOGAT2 (0.43) MOGAT2AKR1B1

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
CN-112771046-B Other substituted triazoloquinoxaline derivatives 格吕伦塔尔有限公司 2023-09-19 — — CN disclosed
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