SCHEMBL9284192

SCHEMBL9284192

O=C(S)COc1cccc2cccnc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.68
▸ SMN1; SMN2 Q16637 5/20 0.63
▸ NPC1 O15118 4/20 0.63
▸ RAB9A P51151 4/20 0.63
▸ L3MBTL1 Q9Y468 3/20 0.63
▸ ALDH1A1 P00352 7/20 0.59
▸ POLB P06746 6/20 0.59
▸ TP53 P04637 2/20 0.59
▸ USP2 O75604 1/20 0.59
▸ CASP1 P29466 1/20 0.59
▸ BRCA1 P38398 1/20 0.59
▸ CASP7 P55210 1/20 0.59
▸ NPSR1 Q6W5P4 1/20 0.59
▸ HPGD P15428 2/20 0.58
▸ GAA P10253 1/20 0.55
▸ RXFP1 Q9HBX9 1/20 0.55
▸ LMNA P02545 3/20 0.55
▸ HDAC6 Q9UBN7 2/20 0.55
▸ METAP2 P50579 1/20 0.55
▸ METAP1 P53582 1/20 0.55

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
SCHEMBL45506 0.87 MAPT (0.68) MAPTSMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL4309362 0.85 MAPT (0.71) MAPTSMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL8871046 0.85 MAPT (0.67) MAPTSMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL8871380 0.81 SMN1; SMN2 (0.65) MAPTSMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL28678208 0.81 MAPT (1.00) MAPTSMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL8886917 0.81 MAPT (0.61) MAPTSMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL15818384 0.80 MAPT (0.60) MAPTSMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL9284194 0.80 MAPT (0.60) MAPTSMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL9343462 0.79 MAPT (0.59) MAPTSMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL8624763 0.79 MAPT (0.59) MAPTSMN1; SMN2NPC1RAB9AL3MBTL1

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-0407341-B1 Selective herbicidal agent CIBA GEIGY AG (CH) 1995-12-06 — — EP claimed
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