SCHEMBL9874891

SCHEMBL9874891

Cc1nc2cccnc2c(Cl)c1C(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.54
MAPT P10636 2/20 0.51
GAA P10253 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
KDM4E B2RXH2 1/20 0.45
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
DHODH Q02127 2/20 0.40
ALDH1A1 P00352 2/20 0.40
PDE10A Q9Y233 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 2/20 0.39
KDR P35968 1/20 0.39
METAP2 P50579 1/20 0.39
METAP1 P53582 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
FABP3 P05413 1/20 0.39
FABP4 P15090 1/20 0.39

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
SCHEMBL9874905 0.84 HTT (0.55) HTTMAPTGAANPSR1KMT2A
SCHEMBL9381144 0.75 HTT (0.40) HTTMAPTGAANPSR1KMT2A
SCHEMBL29108495 0.75 LMNA (0.46) MAPTKDM4EHSD17B10DHODHALDH1A1
SCHEMBL30640157 0.75 LMNA (0.46) MAPTKDM4EHSD17B10DHODHALDH1A1
SCHEMBL9873674 0.74 KMT2A (0.42) HTTMAPTNPSR1KMT2AMEN1
SCHEMBL12564559 0.74 PABPC1 (0.44) MAPTKMT2AMEN1KDM4ETP53
SCHEMBL20659711 0.72 PDE10A (0.61) HTTMAPTNPSR1KMT2AMEN1
SCHEMBL20669725 0.71 PDE10A (0.47) HTTMAPTNPSR1KDM4ETP53
SCHEMBL1991038 0.70 KDM4E (0.43) HTTMAPTGAANPSR1KMT2A
SCHEMBL30640208 0.70 KDM4E (0.43) HTTMAPTGAANPSR1KMT2A

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
US-5026711-A Prevention and treatment of cardiovascular disorders and infections states; anxiolytic and anti-allergic agents SANOFI (FR) 1991-06-25 US disclosed