SCHEMBL18691786

SCHEMBL18691786

CCOC(=O)c1nc2cccnc2n(C)c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.60
▸ SMN1; SMN2 Q16637 4/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ MAPK1 P28482 2/20 0.54
▸ MAPT P10636 2/20 0.54
▸ KMT2A Q03164 4/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ TSHR P16473 5/20 0.52
▸ USP2 O75604 2/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ BRD4 O60885 1/20 0.49
▸ POLB P06746 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ CSF1R P07333 1/20 0.46
▸ HTR3E A5X5Y0 1/20 0.45
▸ HTR3B O95264 1/20 0.45
▸ HTR3A P46098 1/20 0.45
▸ HTR3D Q70Z44 1/20 0.45
▸ HTR3C Q8WXA8 1/20 0.45
▸ MEN1 O00255 2/20 0.45

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
SCHEMBL3008954 0.83 CSF1R (0.63) SMN1; SMN2ALDH1A1MAPTKMT2AALOX15
SCHEMBL18691779 0.81 LMNA (0.62) LMNASMN1; SMN2ALDH1A1MAPK1MAPT
SCHEMBL18691781 0.81 ALDH1A1 (0.52) LMNASMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL11392754 0.80 CSF1R (0.55) KMT2ATSHRPOLBCSF1RMEN1
SCHEMBL2783058 0.80 OGFRL1 (0.56) ALDH1A1MAPK1MAPTTSHRHSD17B10
SCHEMBL18691776 0.80 ALDH1A1 (0.48) LMNAALDH1A1MAPTKMT2AALOX15
SCHEMBL18691772 0.80 ADORA3 (0.49) LMNAALDH1A1KMT2ATSHRBRD4
SCHEMBL2782278 0.79 CSF1R (0.54) LMNASMN1; SMN2ALDH1A1MAPK1MAPT
SCHEMBL2783043 0.77 PDE4B (0.56) LMNAKMT2ATSHRPOLBCSF1R
SCHEMBL1372818 0.77 AHR (0.55) LMNAALDH1A1KMT2ATSHRBRD4

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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