SCHEMBL28964196

SCHEMBL28964196

CC(C)c1cccc(F)c1C1CCCN1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.40
CHRM5 P08912 5/20 0.37
CHRM3 P20309 5/20 0.37
CHRM2 P08172 5/20 0.37
CHRM1 P11229 4/20 0.37
CHRM4 P08173 4/20 0.37
CHRNB2 P17787 1/20 0.36
CHRNA7 P36544 1/20 0.36
CHRNA4 P43681 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HCRTR2 O43614 1/20 0.35
ANPEP P15144 1/20 0.35
DPP4 P27487 1/20 0.35

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
SCHEMBL20575902 0.84 CHRM5 (0.46) CHRM5CHRM3CHRM2CHRM1CHRM4
SCHEMBL29589051 0.84 CHRM5 (0.46) CHRM5CHRM3CHRM2CHRM1CHRM4
Hydrochloric Acid SCHEMBL31444377 0.82 CHRM5 (0.44) CHRM5CHRM3CHRM2CHRM1CHRM4
SCHEMBL1765240 0.79 MEN1 (0.46) CHRM5CHRM3CHRM2CHRM1CHRM4
SCHEMBL24774560 0.76 KMT2A (0.42) CHRM5CHRM3CHRM2CHRM1CHRM4
SCHEMBL22380101 0.75 ABCB1 (0.44) CHRNB2CHRNA4ANPEPDPP4
SCHEMBL31198384 0.75 CHRNB2 (0.45) CHRM5CHRM3CHRM2CHRM1CHRM4
SCHEMBL23057911 0.74 TAAR1 (0.43) TAAR1CHRM5CHRM3CHRM2CHRM1
SCHEMBL23323076 0.74 TAAR1 (0.43) TAAR1CHRM5CHRM3CHRM2CHRM1
SCHEMBL23323218 0.74 TAAR1 (0.43) TAAR1CHRM5CHRM3CHRM2CHRM1

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
CN-115490708-B Sulfonamide macrocyclic derivative, preparation method and application thereof 苏州亚盛药业有限公司 2025-01-24 CN disclosed
CN-115490708-A Sulfonamide macrocyclic derivatives, and preparation method and application thereof 苏州亚盛药业有限公司 2022-12-20 CN disclosed