SCHEMBL26674609

SCHEMBL26674609

CC1(C)OB(c2cccnc2NCC(F)(F)F)OC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LIPE Q05469 8/20 0.36
▸ CXCR2 P25025 2/20 0.33
▸ IRAK1 P51617 1/20 0.33
▸ MAT2A P31153 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ DGAT1 O75907 1/20 0.32
▸ DHODH Q02127 1/20 0.30
▸ HDAC6 Q9UBN7 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
SCHEMBL30641310 1.00 LIPE (0.36) LIPECXCR2IRAK1MAT2APOLB
SCHEMBL22574535 0.83 LPL (0.37) LIPECXCR2POLB
SCHEMBL16967950 0.78 LPL (0.35) LIPECXCR2
SCHEMBL26674635 0.77 LIPE (0.43) LIPECXCR2
SCHEMBL24879916 0.75 EPHX2 (0.49) LIPEDHODH
SCHEMBL31441746 0.74 LRRK2 (0.33) LIPE
SCHEMBL29879749 0.74 LIPE (0.42) LIPE
SCHEMBL25300352 0.74 LIPE (0.42) LIPE
SCHEMBL9955932 0.74 LIPE (0.38) LIPECXCR2DGAT1
SCHEMBL27449514 0.73 CASP6 (0.58) —

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-4526293-A1 HETEROARENES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND METHODS OF USING THE SAME Repare Therapeutics Inc. (CA) 2025-03-26 — — EP disclosed
WO-2023220831-A1 HETEROARENES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND METHODS OF USING THE SAME REPARE THERAPEUTICS INC. (CA) 2023-11-23 — — WO disclosed
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