SCHEMBL11276985

SCHEMBL11276985

CC1SCCCNc2ccc(I)cc21

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34

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
Hydrochloric Acid SCHEMBL11275784 0.98 CA1 (0.33) CA1CA2
SCHEMBL11275332 0.83 MAPT (0.36) CA1CA2
SCHEMBL11263563 0.81 HTR2C (0.39) CA1CA2
Hydrochloric Acid SCHEMBL11273176 0.81 MAPT (0.35) CA1CA2
SCHEMBL11260229 0.81 HTR2A (0.39) CA1CA2
SCHEMBL11262097 0.81 HTR2C (0.39) CA1CA2
Hydrochloric Acid SCHEMBL11269902 0.80 HTR2C (0.38) CA1CA2
Hydrochloric Acid SCHEMBL11270222 0.80 HTR2A (0.38) CA1CA2
Hydrochloric Acid SCHEMBL11267162 0.80 HTR2C (0.38) CA1CA2
SCHEMBL11275856 0.79 KIF11 (0.35)

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
US-4328238-A ANTIDEPRESSANTS, ANTISECRETORY, AND ANTIULCER AGENTS SANKYO COMPANY LIMITED (JP) 1982-05-04 US claimed
US-4328238-A ANTIDEPRESSANTS, ANTISECRETORY, AND ANTIULCER AGENTS SANKYO COMPANY LIMITED (JP) 1982-05-04 US disclosed