SCHEMBL27417593

SCHEMBL27417593

CCOC(=O)c1c(C(F)(F)F)c(C2CC2)nn1CC1(C)CC(F)(F)C1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 3/20 0.32
TSHR P16473 3/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PLAT P00750 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
FDFT1 P37268 1/20 0.31
FAAH O00519 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
SCHEMBL30975872 0.93 KMT2A (0.32) KMT2AALDH1A1TSHRGAAHTT
SCHEMBL30975903 0.88 KMT2A (0.36) KMT2AALDH1A1KDM4EHPGD
SCHEMBL30976004 0.87 ALDH1A1 (0.33) KMT2AALDH1A1TSHRGAAHTT
SCHEMBL30976162 0.87 KMT2A (0.35) KMT2AALDH1A1TSHRGAAHTT
SCHEMBL30976051 0.86 KMT2A (0.32) KMT2A
SCHEMBL30975989 0.86 PTGER4 (0.32)
SCHEMBL30976018 0.86 ALDH1A1 (0.32) KMT2AALDH1A1TSHRGAAHTT
SCHEMBL30975865 0.85 PTGER4 (0.30)
SCHEMBL30976001 0.85 PTGDR2 (0.31)
SCHEMBL30975900 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4634159-A1 SULFOXIMINES AS INHIBITORS OF NAV1.8 Grünenthal GmbH (DE) 2025-10-22 EP disclosed
WO-2024126648-A1 SULFOXIMINES AS INHIBITORS OF NaV1.8 Grünenthal GmbH (DE) 2024-06-20 WO disclosed
WO-2024126648-A1 SULFOXIMINES AS INHIBITORS OF NaV1.8 Grünenthal GmbH (DE) 2024-06-20 WO disclosed