SCHEMBL11114425

SCHEMBL11114425

CSc1ccc2c(c1)N(C(C)=O)c1ccccc1CC2

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
ALDH1A1 P00352 1/20 0.61
POLB P06746 1/20 0.56
HSD17B3 P37058 7/20 0.48
NOTUM Q6P988 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 1/20 0.44
NPC1 O15118 1/20 0.44
MITF O75030 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL11111811 0.87 KDM4E (0.47) KDM4EL3MBTL1ALDH1A1POLBHSD17B3
SCHEMBL11548268 0.83 KDM4E (0.67) KDM4EL3MBTL1ALDH1A1POLBHSD17B3
SCHEMBL31182095 0.83 KDM4E (0.67) KDM4EL3MBTL1ALDH1A1POLBHSD17B3
SCHEMBL25784150 0.81 KDM4E (0.66) KDM4EL3MBTL1ALDH1A1POLBHSD17B3
SCHEMBL23875654 0.79 HSD17B3 (0.68) KDM4EL3MBTL1ALDH1A1POLBHSD17B3
SCHEMBL4806681 0.79 KDM4E (0.68) KDM4EL3MBTL1ALDH1A1POLBHSD17B3
SCHEMBL11108730 0.79 HSD17B3 (0.66) KDM4EL3MBTL1ALDH1A1POLBHSD17B3
SCHEMBL19224983 0.79 HSD17B3 (0.66) KDM4EL3MBTL1ALDH1A1POLBHSD17B3
SCHEMBL30982111 0.79 HSD17B3 (0.68) KDM4EL3MBTL1ALDH1A1POLBHSD17B3
SCHEMBL4809705 0.78 KDM4E (0.63) KDM4EL3MBTL1ALDH1A1POLBHSD17B3

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-0108715-A1 Dibenzazepine carboxamides CIBA-GEIGY AG (CH) 1984-05-16 EP disclosed