SCHEMBL11855385

SCHEMBL11855385

C=Cc1ccc(CN2CC2C)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ HRH2 P25021 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ HRH4 Q9H3N8 1/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.37
▸ PDK1 Q15118 1/20 0.37
▸ PDK2 Q15119 1/20 0.37
▸ PDK3 Q15120 1/20 0.37
▸ PDK4 Q16654 1/20 0.37

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
SCHEMBL19088936 0.78 FAAH (0.41) MAPTHRH2TP53PDK1PDK2
SCHEMBL18930552 0.76 KDM4E (0.49) ALDH1A1KDM4EHRH4HRH3
SCHEMBL4048121 0.74 MAPT (0.68) MAPTHRH2PDK1PDK2PDK3
SCHEMBL6741206 0.74 MAPT (0.68) MAPTHRH2PDK1PDK2PDK3
SCHEMBL14305457 0.74 HRH3 (0.67) ALDH1A1HRH4HRH3
SCHEMBL19362304 0.73 ALDH1A1 (0.44) MAPTALDH1A1CA1CA2MEN1
SCHEMBL6927881 0.73 OPRD1 (0.61) MAPTKDM4EPDK1PDK2PDK3
SCHEMBL4870263 0.72 HRH3 (0.52) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL12531233 0.72 HRH3 (0.52) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL608338 0.72 HRH3 (0.52) MAPTALDH1A1MEN1KMT2AKDM4E

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
US-3996204-A Novel N-(ar-vinylbenzyl)aziridines THE DOW CHEMICAL COMPANY (US) 1976-12-07 — — US disclosed
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