SCHEMBL30956296

SCHEMBL30956296

CC1CN1Cc1cccc(CN2CC2C)c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.51
▸ SIGMAR1 Q99720 1/20 0.47
▸ PDK1 Q15118 1/20 0.43
▸ PDK2 Q15119 1/20 0.43
▸ PDK3 Q15120 1/20 0.43
▸ PDK4 Q16654 1/20 0.43
▸ HRH2 P25021 1/20 0.41
▸ PRMT6 Q96LA8 1/20 0.40
▸ MGAM O43451 1/20 0.40
▸ MAPK14 Q16539 1/20 0.39
▸ BRD4 O60885 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL6741206 0.84 MAPT (0.68) MAPTSIGMAR1PDK1PDK2PDK3
SCHEMBL27979641 0.84 MAPT (0.68) MAPTSIGMAR1PDK1PDK2PDK3
SCHEMBL4048121 0.84 MAPT (0.68) MAPTSIGMAR1PDK1PDK2PDK3
SCHEMBL6742277 0.83 MAPT (0.66) MAPTSIGMAR1PDK1PDK2PDK3
SCHEMBL6742274 0.83 MAPT (0.66) MAPTSIGMAR1PDK1PDK2PDK3
SCHEMBL19088936 0.81 FAAH (0.41) MAPTSIGMAR1PDK1PDK2PDK3
SCHEMBL1190075 0.75 SIGMAR1 (0.57) MAPTSIGMAR1PDK1PDK2PDK3
SCHEMBL1189176 0.75 SIGMAR1 (0.57) MAPTSIGMAR1PDK1PDK2PDK3
SCHEMBL18411348 0.74 SIGMAR1 (0.53) MAPTSIGMAR1BRD4HRH3
SCHEMBL17426061 0.74 MAPT (0.70) MAPTSIGMAR1PDK1PDK2PDK3

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-109306630-B Cross-linking agent for aqueous acrylic adhesive and obtained adhesive 广东灵捷制造化工有限公司 2024-06-18 — — CN disclosed
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