SCHEMBL11513755

SCHEMBL11513755

COS(=O)(=O)c1ccc(C)cc1.Cc1nccn1Cc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.47
▸ LIMK2 P53671 1/20 0.46
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ LMNA P02545 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ HTT P42858 1/20 0.41
▸ OPRD1 P41143 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ BRD4 O60885 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40

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
SCHEMBL81625 0.80 LMNA (0.63) NPC1RAB9ASMN1; SMN2LMNAL3MBTL1
Benzene SCHEMBL27902631 0.80 LMNA (0.63) NPC1RAB9ASMN1; SMN2LMNAL3MBTL1
SCHEMBL30779764 0.78 LMNA (0.61) NPC1RAB9ASMN1; SMN2LMNAL3MBTL1
Water SCHEMBL10592152 0.78 LMNA (0.61) NPC1RAB9ASMN1; SMN2LMNAL3MBTL1
Bromide SCHEMBL31469205 0.78 LMNA (0.61) NPC1RAB9ASMN1; SMN2LMNAL3MBTL1
Hydrochloric Acid SCHEMBL7143179 0.78 L3MBTL1 (0.61) LMNAL3MBTL1MEN1KMT2ATDP1
Iodide SCHEMBL1841532 0.78 LMNA (0.61) NPC1RAB9ASMN1; SMN2LMNAL3MBTL1
Iodomethane SCHEMBL11514034 0.77 LMNA (0.59) NPC1RAB9ASMN1; SMN2LMNAL3MBTL1
SCHEMBL169675 0.77 LMNA (0.68) NPC1RAB9ASMN1; SMN2LMNAL3MBTL1
(Chloromethyl)Benzene SCHEMBL28084432 0.76 BCHE (0.47) SMN1; SMN2LMNAL3MBTL1MEN1KMT2A

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-4147543-A Developer compositions for high contrast diffusion transfer photographic materials and process therefor FUJI PHOTO FILM CO., LTD. (JP) 1979-04-03 — — US disclosed
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