SCHEMBL2788916

SCHEMBL2788916

CSNC(=O)Nc1noc2c(F)cccc12

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.47
TP53 P04637 5/20 0.47
SSTR4 P31391 9/20 0.40
MAPT P10636 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL2786513 0.85 SMN1; SMN2 (0.43) SMN1; SMN2TP53SSTR4
SCHEMBL2786181 0.84 SMN1; SMN2 (0.43) SMN1; SMN2TP53SSTR4
SCHEMBL2785433 0.83 SMN1; SMN2 (0.42) SMN1; SMN2TP53SSTR4NPC1RAB9A
SCHEMBL2784747 0.82 TP53 (0.41) SMN1; SMN2TP53SSTR4
SCHEMBL2787064 0.81 TP53 (0.40) SMN1; SMN2TP53SSTR4
SCHEMBL2784882 0.81 TP53 (0.40) SMN1; SMN2TP53SSTR4
SCHEMBL2787968 0.81 TP53 (0.40) SMN1; SMN2TP53SSTR4
SCHEMBL2788190 0.78 SMN1; SMN2 (0.55) SMN1; SMN2TP53MAPTNPC1RAB9A
SCHEMBL2785042 0.77 ALDH1A1 (0.43) SMN1; SMN2TP53L3MBTL1
SCHEMBL2440991 0.76 SMN1; SMN2 (0.59) SMN1; SMN2TP53MAPTNPC1RAB9A

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
EP-1881967-B1 SUBSTITUTED BENZO(D)ISOXAZOL-3-YL AMINE COMPOUNDS AS ANALGESICS GRUENENTHAL GMBH (DE) 2010-04-28 EP claimed