SCHEMBL30668488

SCHEMBL30668488

Cc1ccc(F)c2c1NC(=O)C(C)(C)N2

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MOGAT2 Q3SYC2 7/20 0.38
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ AR P10275 3/20 0.33
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA4 P22748 1/20 0.32
▸ CA7 P43166 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ CES1 P23141 1/20 0.32
▸ AKR1B1 P15121 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ CASP6 P55212 1/20 0.31
▸ CNR1 P21554 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ GPR35 Q9HC97 1/20 0.30
▸ GPR55 Q9Y2T6 1/20 0.30
▸ DAO P14920 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
SCHEMBL21624341 1.00 MOGAT2 (0.38) MOGAT2MEN1KMT2AARCA12
SCHEMBL23647755 0.93 MOGAT2 (0.38) MOGAT2MEN1KMT2AARCA12
SCHEMBL21624380 0.79 PDK2 (0.42) MOGAT2ARAKR1B1
SCHEMBL21624363 0.79 — —
SCHEMBL30668480 0.79 — —
SCHEMBL21624397 0.79 CES1 (0.46) MOGAT2MEN1KMT2ACA12CA1
SCHEMBL30668476 0.79 CES1 (0.46) MOGAT2MEN1KMT2ACA12CA1
SCHEMBL30668452 0.78 MOGAT2 (0.39) MOGAT2MEN1KMT2AARCES1
SCHEMBL21624342 0.78 MOGAT2 (0.39) MOGAT2MEN1KMT2AARCES1
SCHEMBL21624337 0.78 PDK1 (0.44) MOGAT2AR

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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