SCHEMBL10767198

SCHEMBL10767198

C=CCS(=O)(=O)c1ccccc1C=CC1=NNC(=O)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 4/20 0.53
▸ PTGS1 P23219 3/20 0.53
▸ LMNA P02545 4/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.37
▸ PDE3B Q13370 1/20 0.37
▸ PDE3A Q14432 1/20 0.37
▸ MEN1 O00255 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ BRD4 O60885 2/20 0.31
▸ CREBBP Q92793 2/20 0.31

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
SCHEMBL10761925 0.83 PTGS2 (0.53) PTGS2PTGS1LMNASMN1; SMN2RAB9A
SCHEMBL10763645 0.81 PTGS2 (0.62) PTGS2PTGS1LMNASMN1; SMN2RAB9A
SCHEMBL10763049 0.78 RAB9A (0.54) PTGS2PTGS1LMNASMN1; SMN2RAB9A
SCHEMBL10765623 0.77 PDE3A (0.43) PTGS2PTGS1LMNAMAPTKDM4E
SCHEMBL10763307 0.77 PTGS1 (0.58) PTGS2PTGS1LMNASMN1; SMN2RAB9A
SCHEMBL10762648 0.75 RAB9A (0.54) PTGS2PTGS1LMNASMN1; SMN2RAB9A
SCHEMBL10764378 0.75 RAB9A (0.54) PTGS2PTGS1LMNASMN1; SMN2RAB9A
SCHEMBL10763618 0.75 PTGS2 (0.67) PTGS2PTGS1LMNASMN1; SMN2RAB9A
SCHEMBL10760658 0.73 PTGS1 (0.51) PTGS2PTGS1LMNASMN1; SMN2RAB9A
SCHEMBL10760651 0.73 PTGS1 (0.51) PTGS2PTGS1LMNASMN1; SMN2RAB9A

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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