SCHEMBL8941792

SCHEMBL8941792

CC(C)(N)CC(N)C(C)(C)O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
HIF1A Q16665 1/20 0.34
FDPS P14324 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
SCHEMBL11469843 0.80 ALDH1A1 (0.35) FDPS
SCHEMBL18197848 0.80 FDPS (0.31) FDPS
SCHEMBL2627099 0.80 FDPS (0.31) FDPS
SCHEMBL9194464 0.77 CYP1A2 (0.32) CYP1A2CYP3A4CYP2C9HIF1A
SCHEMBL11977370 0.72 CYP1A2 (0.39) CYP1A2CYP3A4CYP2C9HIF1AFDPS
SCHEMBL10904536 0.71
SCHEMBL3853274 0.71
SCHEMBL3852239 0.71
SCHEMBL635741 0.71
SCHEMBL12538862 0.71

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0748344-A1 REACTIVE DILUENT ALDIMINE OXAZOLIDINES ANGUS CHEMICAL COMPANY (US) 1996-12-18 EP disclosed
EP-0748344-A4 REACTIVE DILUENT ALDIMINE OXAZOLIDINES ANGUS CHEMICAL (US) 1996-09-19 EP disclosed
WO-1995011933-A1 REACTIVE DILUENT ALDIMINE OXAZOLIDINES ANGUS CHEMICAL COMPANY (US) 1995-05-04 WO disclosed