SCHEMBL10102084

SCHEMBL10102084

CNc1nc(Cl)cc(C)c1C#N

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.46
HSD17B10 Q99714 3/20 0.46
TSHR P16473 2/20 0.46
ALDH1A1 P00352 5/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HPGD P15428 3/20 0.39
GAA P10253 2/20 0.39
LMNA P02545 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KLK7 P49862 1/20 0.38
RECQL P46063 1/20 0.38
HAVCR2 Q8TDQ0 1/20 0.37

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
SCHEMBL29986241 1.00 KDM4E (0.46) KDM4EHSD17B10TSHRALDH1A1L3MBTL1
SCHEMBL8440869 0.83 KDM4E (0.49) KDM4EHSD17B10TSHRALDH1A1L3MBTL1
SCHEMBL14471354 0.81 ALDH1A1 (0.61) KDM4EHSD17B10TSHRALDH1A1MEN1
SCHEMBL3908276 0.80 ALDH1A1 (0.44) KDM4EHSD17B10TSHRALDH1A1MEN1
SCHEMBL31384575 0.78 ALDH1A1 (0.74) KDM4EHSD17B10TSHRALDH1A1L3MBTL1
SCHEMBL9956692 0.78 ALDH1A1 (0.74) KDM4EHSD17B10TSHRALDH1A1L3MBTL1
SCHEMBL29496331 0.77 L3MBTL1 (0.57) KDM4EHSD17B10TSHRALDH1A1L3MBTL1
SCHEMBL534956 0.77 L3MBTL1 (0.57) KDM4EHSD17B10TSHRALDH1A1L3MBTL1
SCHEMBL10074682 0.77 KDM4E (0.46) KDM4EHSD17B10TSHRALDH1A1L3MBTL1
SCHEMBL14004275 0.76 AURKA (0.46) KDM4EHSD17B10TSHRALDH1A1MEN1

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
CN-117157286-A Pyridyl-substituted oxo-isoindoline compounds 百时美施贵宝公司 2023-12-01 CN disclosed
US-8206465-B2 Azo pigments, pigment dispersion, coloring composition, and ink for inkjet recording FUJIFILM CORPORATION (JP) 2012-06-26 US disclosed
US-20110011306-A1 AZO PIGMENTS, PIGMENT DISPERSION, COLORING COMPOSITION, AND INK FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2011-01-20 US disclosed