SCHEMBL9566834

SCHEMBL9566834

COCCNC(=O)Oc1ccnc(COC)c1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 5/20 0.41
LOX P28300 4/20 0.41
HPGD P15428 3/20 0.40
OPRM1 P35372 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
TP53 P04637 1/20 0.37

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
SCHEMBL9566818 0.92 ALDH1A1 (0.44) HPGD
SCHEMBL9566810 0.90 LOXL2 (0.41) LOXL2LOXHPGDOPRM1CYP1A2
SCHEMBL9566774 0.87 SMN1; SMN2 (0.39)
SCHEMBL9566784 0.86 LMNA (0.44) LOXL2LOXCYP1A2CYP2C9CYP2C19
SCHEMBL9566858 0.85 HPGD (0.43) LOXL2LOXHPGDCYP1A2CYP2C9
SCHEMBL9354128 0.84 LOXL2 (0.48) LOXL2LOXHPGDOPRM1CYP1A2
SCHEMBL9566886 0.82 MEN1 (0.41) CYP1A2
SCHEMBL9566743 0.82 ALDH1A1 (0.44) HPGD
Hydrochloric Acid SCHEMBL9566744 0.81 ALDH1A1 (0.43) HPGD
SCHEMBL9706023 0.81 LOXL2 (0.46) LOXL2LOXHPGDOPRM1CYP1A2

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
EP-0533130-A1 2-Hydroxymethylpyridines, the corresponding pyridine-N-oxides and derivatives thereof, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-24 EP disclosed