SCHEMBL10763071

SCHEMBL10763071

C#CCS(=O)(=O)c1cccc(C=CC2=NNC(=O)CC2)c1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 3/20 0.57
▸ PTGS2 P35354 3/20 0.57
▸ LMNA P02545 3/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ PDE3B Q13370 1/20 0.42
▸ PDE3A Q14432 1/20 0.42
▸ MAOB P27338 5/20 0.33
▸ APOBEC3G Q9HC16 1/20 0.32
▸ CREBBP Q92793 2/20 0.31
▸ BRD4 O60885 1/20 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
SCHEMBL10761349 0.86 RAB9A (0.53) PTGS1PTGS2LMNARAB9ASMN1; SMN2
SCHEMBL10763307 0.83 PTGS1 (0.58) PTGS1PTGS2LMNARAB9ASMN1; SMN2
SCHEMBL10762077 0.81 PTGS1 (0.68) PTGS1PTGS2LMNARAB9ASMN1; SMN2
SCHEMBL10765577 0.79 PDE3B (0.47) PTGS1PTGS2PDE3BPDE3AMAOB
SCHEMBL10761925 0.78 PTGS2 (0.53) PTGS1PTGS2LMNARAB9ASMN1; SMN2
SCHEMBL10760345 0.78 RAB9A (0.53) PTGS1PTGS2LMNARAB9ASMN1; SMN2
SCHEMBL10763395 0.78 SMN1; SMN2 (0.53) PTGS1PTGS2LMNARAB9ASMN1; SMN2
SCHEMBL10766165 0.76 PTGS2 (0.58) PTGS1PTGS2LMNARAB9ASMN1; SMN2
SCHEMBL10762761 0.76 PTGS1 (0.58) PTGS1PTGS2LMNARAB9ASMN1; SMN2
SCHEMBL10759912 0.76 PTGS1 (0.57) PTGS1PTGS2LMNARAB9ASMN1; SMN2

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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