SCHEMBL8650872

SCHEMBL8650872

CC(=O)Cn1nc(-c2ccccc2)nc1N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.57
KMT2A Q03164 6/20 0.55
F2 P00734 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
ALDH1A1 P00352 2/20 0.51
ADORA1 P30542 2/20 0.50
TSHR P16473 1/20 0.50
NR1H2 P55055 2/20 0.48
NR1H3 Q13133 2/20 0.48
KDM4E B2RXH2 4/20 0.47
HSD17B10 Q99714 2/20 0.47
POLB P06746 1/20 0.47
ALOX15 P16050 1/20 0.47
ADORA2A P29274 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HTT P42858 2/20 0.46
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.45
MAPK1 P28482 1/20 0.45
KLK7 P49862 1/20 0.45

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
SCHEMBL28122847 0.74 NR1H3 (0.70) GAAKMT2AF2NPSR1ALDH1A1
SCHEMBL14736604 0.73 TSHR (0.53) GAAKMT2AALDH1A1TSHRNR1H2
SCHEMBL13170058 0.72 GAA (0.37) GAAALDH1A1KDM4EPOLBSMN1; SMN2
SCHEMBL31036994 0.71 TUBB4A (0.33) ALDH1A1KDM4EHSD17B10SMN1; SMN2MAPK1
SCHEMBL15024362 0.70 TSHR (0.69) GAAKMT2AALDH1A1TSHRNR1H2
SCHEMBL2554237 0.70 F12 (0.76) GAAKMT2AF2NPSR1ALDH1A1
SCHEMBL633598 0.70 NR1H2 (0.63) GAAKMT2AF2NPSR1ALDH1A1
SCHEMBL15106505 0.69 KMT2A (0.55) GAAKMT2AF2ALDH1A1TSHR
SCHEMBL11534222 0.68 TSHR (0.66) GAAKMT2AALDH1A1TSHRNR1H2
SCHEMBL15114980 0.68 TSHR (0.66) GAAKMT2AALDH1A1TSHRNR1H2

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
US-5849469-A Process for forming an image using novel magneta couplers for color photography EASTMAN KODAK COMPANY (US) 1998-12-15 US disclosed
EP-0576430-A1 NOVEL MAGENTA COUPLERS FOR COLOUR PHOTOGRAPHY KODAK LIMITED (GB) 1994-01-05 EP disclosed
WO-1992012464-A1 NOVEL MAGENTA COUPLERS FOR COLOUR PHOTOGRAPHY EASTMAN KODAK COMPANY (US) 1992-07-23 WO disclosed