SCHEMBL11068376

SCHEMBL11068376

CCOc1ccc(N(c2ccccc2)C2(c3c(C)n(CC)c4ccccc34)OC(=O)c3cc(C(=O)OC)ccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
KMT2A Q03164 1/20 0.39
PTGER4 P35408 4/20 0.37
ALDH1A1 P00352 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MAPT P10636 3/20 0.34
POLB P06746 1/20 0.34
KDM4E B2RXH2 3/20 0.34
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL11068054 0.95 SMN1; SMN2 (0.41) SMN1; SMN2KMT2APTGER4ALDH1A1NPSR1
SCHEMBL11066385 0.94 SMN1; SMN2 (0.42) SMN1; SMN2KMT2APTGER4ALDH1A1NPSR1
SCHEMBL11068175 0.93 SMN1; SMN2 (0.42) SMN1; SMN2KMT2APTGER4ALDH1A1MAPT
SCHEMBL11062617 0.91 SMN1; SMN2 (0.38) SMN1; SMN2PTGER4ALDH1A1NPSR1MAPT
SCHEMBL11072094 0.89 PLA2G2A (0.37) SMN1; SMN2
SCHEMBL11083992 0.89 SMN1; SMN2 (0.42) SMN1; SMN2KMT2APTGER4ALDH1A1NPSR1
SCHEMBL11062542 0.87 SMN1; SMN2 (0.44) SMN1; SMN2KMT2APTGER4ALDH1A1MAPT
SCHEMBL11065441 0.86 SMN1; SMN2 (0.37) SMN1; SMN2KMT2APTGER4MAPTPOLB
SCHEMBL3873669 0.86 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1NPSR1MAPTPOLB
SCHEMBL11064330 0.85 SMN1; SMN2 (0.40) SMN1; SMN2PTGER4ALDH1A1NPSR1MAPT

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-4431819-A PRESSURE AND HEAT SENSITIVE ELEMENTS; CARBONLESS COPYING; HECTOGRAPHY; XERORAPHY STERLING DRUG INC. (US) 1984-02-14 US claimed