SCHEMBL18691774

SCHEMBL18691774

CCOC(=O)c1nc2cnccc2n(C)c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.47
▸ ATM Q13315 1/20 0.47
▸ KDM4E B2RXH2 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ ADORA3 P0DMS8 1/20 0.44
▸ CSF1R P07333 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.42
▸ POLB P06746 2/20 0.41
▸ RPS6KA5 O75582 1/20 0.41
▸ OPRM1 P35372 3/20 0.41
▸ OPRK1 P41145 3/20 0.41
▸ OGFRL1 Q5TC84 3/20 0.41

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
SCHEMBL18691775 0.90 ELANE (0.45) ELANEKDM4EALDH1A1HSD17B10ADORA3
SCHEMBL2783058 0.83 OGFRL1 (0.56) KDM4EALDH1A1NPC1TP53MAPT
SCHEMBL18691762 0.81 ATM (0.54) ATMKDM4EALDH1A1SMN1; SMN2NPC1
SCHEMBL18691790 0.80 ATM (0.49) ATMKDM4EALDH1A1SMN1; SMN2NPC1
SCHEMBL3346273 0.76 MAPT (0.49) ELANEATMALDH1A1SMN1; SMN2LMNA
SCHEMBL15147594 0.76 TARBP2 (0.48) KDM4EALDH1A1SMN1; SMN2NPC1MAPT
SCHEMBL18691786 0.74 LMNA (0.60) KDM4EALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL18691772 0.74 ADORA3 (0.49) ELANEKDM4EALDH1A1LMNAHPGD
SCHEMBL18691783 0.74 ATM (0.55) ATMKDM4EALDH1A1SMN1; SMN2NPC1
SCHEMBL15147620 0.72 OGFRL1 (0.44) ELANEKDM4EALDH1A1MAPTHSD17B10

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-2247292-B1 PYRIDOPYRAZINONES DERIVATIVES INSULIN SECRETION STIMULATORS, METHODS FOR OBTAINING THEM AND USE THEREOF FOR THE TREATMENT OF DIABETES MERCK PATENT GMBH (DE) 2017-04-12 — — EP disclosed
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