SCHEMBL9778940

SCHEMBL9778940

Clc1ccc(SCCOc2ccc(C3SCCS3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ LMNA P02545 4/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ DRD2 P14416 2/20 0.43
▸ DRD4 P21917 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ DRD3 P35462 1/20 0.42
▸ NPY1R P25929 1/20 0.41
▸ NPY2R P49146 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ MAOB P27338 2/20 0.40
▸ AR P10275 1/20 0.40
▸ ALDH3A1 P30838 1/20 0.38

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
SCHEMBL9778436 0.87 MAOB (0.51) MAPTLMNAALDH1A1DRD2KDM4E
SCHEMBL9778709 0.86 MAPT (0.52) MAPTSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL9778765 0.86 ALDH1A1 (0.45) MAPTSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL9778855 0.81 MAOB (0.49) MAPTLMNAALDH1A1DRD2KDM4E
SCHEMBL9778647 0.77 ALDH1A1 (0.47) MAPTNPC1RAB9ALMNAALDH1A1
SCHEMBL9778824 0.77 MAOB (0.54) MAPTNPC1RAB9ALMNAALDH1A1
SCHEMBL9778731 0.76 MAPT (0.43) MAPTSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL11612852 0.74 MAPT (0.50) MAPTNPC1RAB9ALMNAALDH1A1
SCHEMBL20005618 0.74 DRD2 (0.57) MAPTSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL5824818 0.74 NPC1 (0.57) MAPTSMN1; SMN2NPC1RAB9ALMNA

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-5063197-A Aromatic compound MITSUBISHI PAPER MILLS LIMITED (JP) 1991-11-05 — — US disclosed
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