SCHEMBL10765743

SCHEMBL10765743

O=C1CCC(C=Cc2ccc(S)cc2)=NN1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 9/20 0.67
▸ SMN1; SMN2 Q16637 8/20 0.67
▸ LMNA P02545 3/20 0.67
▸ KDM4E B2RXH2 1/20 0.67
▸ L3MBTL1 Q9Y468 1/20 0.67
▸ NPC1 O15118 5/20 0.62
▸ PKM P14618 3/20 0.62
▸ MAPT P10636 3/20 0.62
▸ POLB P06746 1/20 0.62
▸ GAA P10253 1/20 0.62
▸ PTGS1 P23219 3/20 0.58
▸ PTGS2 P35354 3/20 0.58
▸ PDE3B Q13370 2/20 0.58
▸ PDE3A Q14432 2/20 0.58
▸ MAOB P27338 5/20 0.41
▸ RECQL P46063 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ KMT2A Q03164 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
SCHEMBL10763947 0.85 RAB9A (0.68) RAB9ASMN1; SMN2LMNAKDM4EL3MBTL1
SCHEMBL10763655 0.84 LMNA (0.67) RAB9ASMN1; SMN2LMNAKDM4EL3MBTL1
SCHEMBL10763657 0.84 RAB9A (0.71) RAB9ASMN1; SMN2LMNAKDM4EL3MBTL1
SCHEMBL10764421 0.84 RAB9A (0.67) RAB9ASMN1; SMN2LMNAKDM4EL3MBTL1
SCHEMBL10761784 0.84 SMN1; SMN2 (0.71) RAB9ASMN1; SMN2LMNAKDM4EL3MBTL1
SCHEMBL10972483 0.82 PTGS1 (0.68) RAB9ASMN1; SMN2LMNAKDM4EL3MBTL1
SCHEMBL10762033 0.82 PTGS1 (0.71) RAB9ASMN1; SMN2LMNAKDM4EL3MBTL1
SCHEMBL10762199 0.80 RAB9A (0.66) RAB9ASMN1; SMN2LMNAKDM4EL3MBTL1
SCHEMBL10766348 0.80 RAB9A (0.66) RAB9ASMN1; SMN2LMNAKDM4EL3MBTL1
SCHEMBL10762783 0.80 LMNA (0.62) RAB9ASMN1; SMN2LMNAKDM4EL3MBTL1

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-0210530-A1 6-Arylalkenyl pyridazinones MERCK PATENT GmbH (DE) 1987-02-04 — — EP disclosed
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