SCHEMBL11064330

SCHEMBL11064330

CCOc1ccc(N(c2ccccc2)C2(c3c(C)n(CC)c4ccccc34)OC(=O)c3ccc(C(=O)OCc4ccccc4)cc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 6/20 0.36
ALDH1A1 P00352 4/20 0.36
NPSR1 Q6W5P4 2/20 0.36
CNR2 P34972 1/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35
TP53 P04637 2/20 0.35
HPGD P15428 1/20 0.35
PTGER4 P35408 1/20 0.34

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
SCHEMBL11083992 0.95 SMN1; SMN2 (0.42) SMN1; SMN2MAPTALDH1A1NPSR1NPC1
SCHEMBL11062617 0.94 SMN1; SMN2 (0.38) SMN1; SMN2MAPTALDH1A1NPSR1CNR2
SCHEMBL11066385 0.91 SMN1; SMN2 (0.42) SMN1; SMN2MAPTALDH1A1NPSR1PTGER4
SCHEMBL11062542 0.90 SMN1; SMN2 (0.44) SMN1; SMN2MAPTALDH1A1LMNATP53
SCHEMBL11062208 0.90 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1NPSR1
SCHEMBL11068054 0.89 SMN1; SMN2 (0.41) SMN1; SMN2MAPTALDH1A1NPSR1NPC1
SCHEMBL11068376 0.85 SMN1; SMN2 (0.40) SMN1; SMN2MAPTALDH1A1NPSR1TP53
SCHEMBL11068175 0.84 SMN1; SMN2 (0.42) SMN1; SMN2MAPTALDH1A1TP53HPGD
SCHEMBL11066294 0.84 SMN1; SMN2 (0.39) SMN1; SMN2MAPTALDH1A1PTGER4
SCHEMBL11072094 0.84 PLA2G2A (0.37) SMN1; SMN2

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