SCHEMBL7275085

SCHEMBL7275085

CCc1cc(NC(C)=O)c(C=O)c(CC)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.36
ADCY8 P40145 1/20 0.36
HSD17B10 Q99714 1/20 0.35
PDE10A Q9Y233 1/20 0.34
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 4/20 0.32
POLB P06746 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
GALR2 O43603 1/20 0.32
MITF O75030 1/20 0.32
LMNA P02545 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HPGD P15428 1/20 0.32
XBP1 P17861 1/20 0.32
CCR6 P51684 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ESR1 P03372 1/20 0.32
TSHR P16473 1/20 0.32
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL3179969 0.71 NOS3 (0.39)
SCHEMBL9662788 0.70 CYP2C9 (0.48) HSD17B10ALDH1A1POLBSMN1; SMN2MITF
SCHEMBL9494042 0.69 LMNA (0.50) ADCY8HSD17B10ALDH1A1POLBSMN1; SMN2
SCHEMBL27299051 0.68 KMT2A (0.49) HSD17B10PDE10AMAPK1ALDH1A1POLB
SCHEMBL9651921 0.64 PGK1 (0.43) PGK1HSD17B10MAPK1ALDH1A1POLB
SCHEMBL17682674 0.64 POLB (0.45) ADCY8HSD17B10ALDH1A1POLBSMN1; SMN2
SCHEMBL8882495 0.63 ALDH1A1 (0.53) HSD17B10MAPK1ALDH1A1POLBSMN1; SMN2
SCHEMBL10393720 0.63 PGK1 (0.42) PGK1ADCY8ALDH1A1SMN1; SMN2TSHR
SCHEMBL26688874 0.62 CNKSR1 (0.39) ALDH1A1SMN1; SMN2NPSR1RAB9AKMT2A
SCHEMBL13812018 0.62 CYP2C19 (0.49) HSD17B10MAPK1ALDH1A1POLBSMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0516392-B1 Naphthyridine derivatives as angiotensin II inhibitors ASTRAZENECA AB (SE) 2001-08-29 EP disclosed
US-5294620-A Hypotensive agents or compounds for cardiovascular disorders IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-03-15 US disclosed
US-5217976-A Hypotensive agents, congestive heart failure IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-06-08 US disclosed
EP-0516392-A2 Naphthyridine derivatives as angiotensin II inhibitors ZENECA LIMITED (GB) 1992-12-02 EP disclosed