SCHEMBL46341

SCHEMBL46341

Cc1cnc2c(c1)oc(=O)n2C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35
HPGD P15428 2/20 0.35
HTT P42858 1/20 0.35
MIF P14174 1/20 0.35
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
LMNA P02545 2/20 0.34
PABPC1 P11940 1/20 0.34
RAB9A P51151 3/20 0.34
POLB P06746 2/20 0.34
PKM P14618 2/20 0.34
NPC1 O15118 1/20 0.33
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
THRB P10828 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL21377510 0.81 HSD17B10 (0.53) ALDH1A1HSD17B10HPGDHTTKMT2A
SCHEMBL19023154 0.81 HPGD (0.37) ALDH1A1HSD17B10HPGDHTTKMT2A
SCHEMBL7328412 0.81 HSD17B10 (0.53) ALDH1A1HSD17B10HPGDHTTKMT2A
SCHEMBL17432908 0.81 HSD17B10 (0.34) ALDH1A1HSD17B10HPGDHTTKMT2A
SCHEMBL8473870 0.81 HSD17B10 (0.34) ALDH1A1HSD17B10HPGDHTTKMT2A
SCHEMBL8624806 0.77 HSD17B10 (0.35) ALDH1A1HSD17B10HPGDHTTKMT2A
SCHEMBL8626905 0.77 ALDH1A1 (0.43) ALDH1A1HSD17B10HPGDHTTLMNA
SCHEMBL8624679 0.77 HRH3 (0.33) ALDH1A1HSD17B10HPGDHTTKMT2A
SCHEMBL17813553 0.75 ALDH1A1 (0.35) ALDH1A1HSD17B10HPGDHTTMIF
SCHEMBL8628216 0.74 PDE10A (0.35) ALDH1A1HSD17B10HPGDHTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011151436-A2 NOVEL COMPOUNDS, METHOD FOR USE THEM AND PHARMACEUTICAL COMPOSITION CONTAINING THEM EUROSCREEN S.A. (BE) 2011-12-08 WO disclosed
WO-2011151434-A1 NOVEL COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-12-08 WO disclosed
US-5767128-A ANALGESICS ADIR ET COMPAGNIE (FR) 1998-06-16 US disclosed
US-5618819-A ANALGESICS ADIR ET COMPAGNIE (FR) 1997-04-08 US disclosed
EP-0691339-A1 Amine derivatives of 1,3-dihydro-2H-pyrrolo(2,3-b)pyridin-2-ones and oxazolo(4,5-b)pyridin-2(3H)-ones, their process of preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-01-10 EP disclosed