SCHEMBL14224022

SCHEMBL14224022

COc1ccc(Nc2nc(C#N)c(C#N)s2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.51
KMT2A Q03164 11/20 0.51
SMN1; SMN2 Q16637 10/20 0.51
MEN1 O00255 10/20 0.51
MAPT P10636 10/20 0.51
RAB9A P51151 9/20 0.51
POLB P06746 2/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
GAA P10253 12/20 0.50
KDM4E B2RXH2 8/20 0.50
HPGD P15428 7/20 0.48
LMNA P02545 4/20 0.48
MAPK1 P28482 3/20 0.48
TP53 P04637 1/20 0.48
ALDH1A1 P00352 5/20 0.48
NPSR1 Q6W5P4 3/20 0.48
HTT P42858 2/20 0.48
STAT1 P42224 1/20 0.46

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
SCHEMBL27154138 0.75 GAA (0.58) NPC1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL27262129 0.70 GAA (0.52) NPC1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL14026238 0.69 MAPT (0.51) NPC1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL1822612 0.68 NPC1 (1.00) NPC1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL5450744 0.68 GAA (0.68) NPC1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL12866605 0.66 RAB9A (0.53) NPC1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL12158152 0.66 NPC1 (0.56) NPC1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL205709 0.66 MAPT (0.78) NPC1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL39057 0.66 MAPT (1.00) NPC1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL1459772 0.66 MAPT (1.00) NPC1KMT2ASMN1; SMN2MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7354701-B2 Photographic element with speed-enhancing compound EASTMAN KODAK COMPANY (US) 2008-04-08 US disclosed
US-20070128560-A1 Photographic element with speed-enhancing compound EASTMAN KODAK COMPANY 2007-06-07 US disclosed