SCHEMBL11804643

SCHEMBL11804643

CC(=O)Nc1ccc(C=Nc2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.68
ALDH1A1 P00352 2/20 0.68
L3MBTL1 Q9Y468 2/20 0.68
KDM4E B2RXH2 1/20 0.68
NOX1 Q9Y5S8 1/20 0.66
NPC1 O15118 4/20 0.63
RAB9A P51151 4/20 0.63
MAPT P10636 4/20 0.63
KMT2A Q03164 6/20 0.57
MEN1 O00255 3/20 0.57
NAPRT Q6XQN6 1/20 0.56
HSD17B10 Q99714 1/20 0.56
POLB P06746 2/20 0.54
DDX3X O00571 1/20 0.54
TAAR1 Q96RJ0 1/20 0.54
MAPK1 P28482 1/20 0.54
S100B P04271 1/20 0.53
GAA P10253 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51

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
SCHEMBL11804637 1.00 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1L3MBTL1KDM4ENOX1
SCHEMBL15382226 0.94 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1L3MBTL1KDM4ENOX1
SCHEMBL11804653 0.94 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1L3MBTL1KDM4ENOX1
SCHEMBL23771218 0.86 TDP1 (0.62) SMN1; SMN2ALDH1A1L3MBTL1KDM4ENOX1
SCHEMBL24113934 0.82 SMN1; SMN2 (0.62) SMN1; SMN2ALDH1A1L3MBTL1KDM4ENOX1
SCHEMBL9276468 0.81 KDM4E (0.62) SMN1; SMN2ALDH1A1L3MBTL1KDM4ENOX1
SCHEMBL11887803 0.80 KMT2A (0.58) SMN1; SMN2ALDH1A1L3MBTL1KDM4ENPC1
SCHEMBL11746811 0.79 NOX1 (0.63) SMN1; SMN2ALDH1A1L3MBTL1KDM4ENOX1
SCHEMBL11686273 0.78 CYP3A4 (0.59) SMN1; SMN2ALDH1A1L3MBTL1KDM4ENOX1
SCHEMBL11686267 0.78 CYP3A4 (0.59) SMN1; SMN2ALDH1A1L3MBTL1KDM4ENOX1

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-3993645-A Stilbene optical brighteners and compositions brightened therewith STERLING DRUG INC. (US) 1976-11-23 US disclosed
US-3932301-A NYLON, POLYESTERS STERLING DRUG INC. (US) 1976-01-13 US disclosed