SCHEMBL22679386

SCHEMBL22679386

Cc1cc(C(C)C(C)C)c(C)cn1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
UHRF1 Q96T88 1/20 0.40
CYP1A2 P05177 1/20 0.34
CYP2A6 P11509 1/20 0.34
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32

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
SCHEMBL10222485 0.82 UHRF1 (0.43) UHRF1CYP1A2CYP2A6NOS3NOS1
SCHEMBL21711087 0.72 UHRF1 (0.35) UHRF1CYP1A2CYP2A6
SCHEMBL12848758 0.72 UHRF1 (0.41) UHRF1CYP1A2CYP2A6
SCHEMBL27334254 0.71 UHRF1 (0.34) UHRF1
SCHEMBL2611021 0.70 UHRF1 (0.50) UHRF1CYP1A2CYP2A6
SCHEMBL138354 0.68
SCHEMBL29503884 0.68
SCHEMBL24220127 0.67 NOS3 (0.43) NOS3NOS1NOS2
SCHEMBL18594716 0.65
SCHEMBL22299273 0.65 LMNA (0.39) UHRF1CYP1A2CYP2A6

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
EP-3412660-B1 SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME EA PHARMA CO LTD (JP) 2020-11-18 EP disclosed