SCHEMBL18691779

SCHEMBL18691779

CCOC(=O)Cc1nc2cccnc2n(C)c1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.62
▸ ALOX15 P16050 1/20 0.54
▸ ALDH1A1 P00352 4/20 0.53
▸ KDM4E B2RXH2 3/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ RXFP1 Q9HBX9 1/20 0.53
▸ SMN1; SMN2 Q16637 5/20 0.49
▸ TSHR P16473 3/20 0.47
▸ MAPK1 P28482 2/20 0.46
▸ MAPT P10636 1/20 0.46
▸ PDE4A P27815 1/20 0.46
▸ PDE4B Q07343 1/20 0.46
▸ PDE4C Q08493 1/20 0.46
▸ PDE4D Q08499 1/20 0.46
▸ RECQL P46063 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ HTR3E A5X5Y0 1/20 0.44

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
SCHEMBL18691782 0.87 LMNA (0.56) LMNAALOX15ALDH1A1KDM4ESMN1; SMN2
SCHEMBL18691786 0.81 LMNA (0.60) LMNAALOX15ALDH1A1KDM4EMEN1
SCHEMBL18691794 0.80 ALDH1A1 (0.50) LMNAALDH1A1KDM4EMEN1KMT2A
SCHEMBL18691777 0.77 HDAC6 (0.66) LMNAALOX15ALDH1A1KDM4EMEN1
SCHEMBL18691792 0.75 HDAC6 (0.56) LMNAALOX15ALDH1A1KDM4EMEN1
SCHEMBL14358207 0.73 CYP1A2 (0.50) LMNAALDH1A1KDM4EMEN1KMT2A
SCHEMBL6344652 0.72 MAPT (0.54) LMNAALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL18691781 0.72 ALDH1A1 (0.52) LMNAALOX15ALDH1A1KDM4EMEN1
SCHEMBL7010780 0.71 MAPT (0.53) LMNAALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL1989725 0.71 ALDH1A1 (0.46) LMNAALDH1A1KDM4EMEN1KMT2A

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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