SCHEMBL11632595

SCHEMBL11632595

CC(C)(C)N=C=O.CCCCN=C=O

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 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
SCHEMBL11646108 0.92 NAAA (0.47) NAAA
SCHEMBL9919 0.86
Octane SCHEMBL9437891 0.84 TSHR (0.40) NAAA
Fluoride SCHEMBL28174258 0.84
Hexane SCHEMBL28217815 0.84 NAAA (0.48) NAAA
Hydrochloric Acid SCHEMBL8196526 0.84
SCHEMBL11007310 0.79 NAAA (0.39) NAAA
Benzene SCHEMBL28876662 0.79 NAAA (0.39) NAAA
Benzene SCHEMBL11855931 0.79 NAAA (0.39) NAAA
SCHEMBL28163436 0.79 NAAA (0.56) NAAA

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-4104251-A POLYMER STABILIZERS HOECHST AKTIENGESELLSCHAFT (DE) 1978-08-01 US disclosed