SCHEMBL3385702

SCHEMBL3385702

Nc1ncc(C2(O)CCOCC2)s1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
NOS1 P29475 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.30
CYP11B2 P19099 2/20 0.30
CYP11B1 P15538 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 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
SCHEMBL3200515 0.84 SMN1; SMN2 (0.39) NOS1SMN1; SMN2ALDH1A1HPGDALOX15
SCHEMBL9126942 0.81 SMN1; SMN2 (0.35) SMN1; SMN2
SCHEMBL12524984 0.72 NOS1 (0.30) NOS1
SCHEMBL5875592 0.68 OPRL1 (0.56) ALDH1A1
SCHEMBL17055342 0.66 OGA (0.40) SMN1; SMN2CYP11B2CYP11B1
SCHEMBL3634429 0.66 CYP11B2 (0.30) CYP11B2
SCHEMBL3634806 0.65 SYK (0.38) SMN1; SMN2ALDH1A1
SCHEMBL24784411 0.64 HCAR2 (0.39) SMN1; SMN2ALDH1A1
SCHEMBL9085983 0.64 HTT (0.36) GAAHPGD
SCHEMBL3632095 0.63 SYK (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
EP-1904494-B1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS LILLY CO ELI (US) 2010-12-01 EP disclosed