SCHEMBL17512920

SCHEMBL17512920

CCCN(C)CC=C(C)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
EP300 Q09472 1/20 0.31
ARG1 P05089 1/20 0.30
ARG2 P78540 1/20 0.30
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL17350523 0.83 CD81 (0.30) KDM5AKDM4C
SCHEMBL3278738 0.82 CA12 (0.35) EP300CA12CA2CA9
SCHEMBL29003190 0.79 PIK3CD (0.37)
SCHEMBL22346 0.76 CD81 (0.33)
SCHEMBL9969645 0.76 SQLE (0.31)
SCHEMBL10896901 0.76 CD81 (0.33)
SCHEMBL3282618 0.74 CA12 (0.39) KDM5AKDM4CEP300CA12CA9
Acetic Acid SCHEMBL3414136 0.73 KDM4C (0.47) KDM5AKDM4CARG1ARG2CA12
SCHEMBL714285 0.72 CHRM2 (0.33)
SCHEMBL29003374 0.72 CHRM2 (0.33)

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-20160054671-A1 TONER ZEON CORPORATION (JP) 2016-02-25 US disclosed