SCHEMBL4437043

SCHEMBL4437043

O=C(O)c1nc2c(Cl)cccc2cc1CCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
MAPT P10636 2/20 0.42
RAB9A P51151 2/20 0.42
GAA P10253 2/20 0.42
KDM4E B2RXH2 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KMT2A Q03164 4/20 0.41
LMNA P02545 2/20 0.40
RXFP1 Q9HBX9 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 1/20 0.40
HTT P42858 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
CASP3 P42574 1/20 0.39
MEN1 O00255 3/20 0.38
HPGD P15428 2/20 0.38
CYP1A2 P05177 1/20 0.38
PDE10A Q9Y233 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL4433755 0.84 LMNA (0.44) ALDH1A1MAPTRAB9AGAAKDM4E
SCHEMBL4436943 0.84 HTT (0.43) ALDH1A1MAPTGAASMN1; SMN2KMT2A
SCHEMBL4437052 0.81 LMNA (0.41) ALDH1A1MAPTRAB9AGAAKDM4E
SCHEMBL4432749 0.80 LMNA (0.40) ALDH1A1MAPTRAB9AGAAKDM4E
SCHEMBL16585132 0.77 HSD17B10 (0.46) ALDH1A1MAPTRAB9AGAAKDM4E
SCHEMBL4437361 0.76 ALDH1A1 (0.41) ALDH1A1MAPTRAB9AGAAKDM4E
SCHEMBL4443119 0.75 LMNA (0.41) ALDH1A1MAPTRAB9AGAAKDM4E
SCHEMBL4172076 0.74 NPSR1 (0.48) ALDH1A1MAPTGAAKDM4ESMN1; SMN2
SCHEMBL4174787 0.73 LMNA (0.41) ALDH1A1GAAKDM4ESMN1; SMN2KMT2A
SCHEMBL4174792 0.73 LMNA (0.41) ALDH1A1GAAKDM4ESMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3045458-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen, Inc (US) 2016-07-20 EP disclosed
EP-2137186-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen Inc. (US) 2009-12-30 EP disclosed
WO-2008118468-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2008-10-02 WO disclosed