SCHEMBL10763395

SCHEMBL10763395

C#CCS(=O)(=O)c1cc(C=CC2=NNC(=O)CC2)ccc1OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.53
▸ LMNA P02545 3/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ L3MBTL1 Q9Y468 3/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ PTGS2 P35354 4/20 0.48
▸ PTGS1 P23219 3/20 0.48
▸ POLB P06746 4/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ PDE3B Q13370 2/20 0.41
▸ PDE3A Q14432 2/20 0.41
▸ PDE4B Q07343 3/20 0.38
▸ PDE4A P27815 1/20 0.38
▸ PDE4C Q08493 1/20 0.38
▸ PDE4D Q08499 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.35
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL10760345 0.92 RAB9A (0.53) SMN1; SMN2LMNARAB9AL3MBTL1KDM4E
SCHEMBL10762648 0.85 RAB9A (0.54) SMN1; SMN2LMNARAB9AL3MBTL1KDM4E
SCHEMBL10763511 0.84 SMN1; SMN2 (0.60) SMN1; SMN2LMNARAB9AL3MBTL1KDM4E
SCHEMBL10762363 0.82 LMNA (0.56) SMN1; SMN2LMNARAB9AL3MBTL1KDM4E
SCHEMBL10761165 0.82 PDE3A (0.47) SMN1; SMN2L3MBTL1POLBMAPTPDE3B
SCHEMBL10761349 0.80 RAB9A (0.53) SMN1; SMN2LMNARAB9AL3MBTL1KDM4E
SCHEMBL10765902 0.79 SMN1; SMN2 (0.69) SMN1; SMN2LMNARAB9AL3MBTL1KDM4E
SCHEMBL10763071 0.78 PTGS1 (0.57) SMN1; SMN2LMNARAB9AL3MBTL1KDM4E
SCHEMBL10764022 0.78 RAB9A (0.53) SMN1; SMN2LMNARAB9AL3MBTL1KDM4E
SCHEMBL10760888 0.78 LMNA (0.60) SMN1; SMN2LMNARAB9AL3MBTL1KDM4E

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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