SCHEMBL8962640

SCHEMBL8962640

C=CC(=O)N(C)C(=O)CCCBr

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
LMNA P02545 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
SCHEMBL8962585 0.79 ALDH1A1 (0.45) ALDH1A1
SCHEMBL8963184 0.78 ACHE (0.44) ALDH1A1LMNA
SCHEMBL8528460 0.73 ALDH1A1 (0.33) ALDH1A1
SCHEMBL14849924 0.72 ZDHHC20 (0.34) ALDH1A1
SCHEMBL7389052 0.72
SCHEMBL25015153 0.71 ALDH1A1 (0.32) ALDH1A1
SCHEMBL28895274 0.71 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5699611 0.71 ALDH1A1 (0.44) ALDH1A1LMNA
SCHEMBL14836759 0.69 ZDHHC20 (0.39)
SCHEMBL8529532 0.68 HSD17B10 (0.30) ALDH1A1

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-5560749-A MIXTURE OF A PEROXY COMPOUND AND (CO)POLYMERIC PRECURSOR CONTAINING ACRYLIMIDE MOITIES; NONSENSITIZING TO SKIN; ANTISOILANTS LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1996-10-01 US disclosed