Sugi Predict

Sugi Predict / Compounds / Pyridine

Pyridine

Pyridine

SCHEMBL28314950

CC(C)(C)OC(=O)n1ccc(O)c1.c1ccncc1

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 6/20 0.40
▸ GRM5 P41594 3/20 0.36
▸ GRM1 Q13255 3/20 0.36
▸ BCHE P06276 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ GBA1 P04062 1/20 0.34
▸ BUB1 O43683 1/20 0.34
▸ ESR2 Q92731 1/20 0.34
▸ HTT P42858 1/20 0.33

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
SCHEMBL7528678 0.88 ESR2 (0.40) GPR119BCHEBUB1ESR2
SCHEMBL19638080 0.72 GPR119 (0.38) GPR119GRM5GRM1BCHEBUB1
SCHEMBL28282013 0.72 GPR119 (0.39) GPR119BCHEGBA1
SCHEMBL11911366 0.72 GPR119 (0.39) GPR119GRM5GRM1BCHEBUB1
SCHEMBL12593934 0.70 NR1H2 (0.41) GPR119BCHEBUB1ESR2
SCHEMBL20033881 0.70 BCHE (0.38) GPR119BCHEBUB1ESR2
SCHEMBL28581988 0.70 BCHE (0.38) GPR119GRM5GRM1BCHEBUB1
SCHEMBL1018306 0.70 BCHE (0.38) GPR119BCHEBUB1ESR2
SCHEMBL15687908 0.70 POLB (0.38) GPR119BCHEPOLB
SCHEMBL21190321 0.69 BCHE (0.44) GPR119BCHEBUB1ESR2

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
CN-110177786-A Pyrazolo [1,5-A] pyridine compounds being substituted are as RET kinase inhibitor 阿雷生物药品公司 2019-08-27 — — CN disclosed