SCHEMBL10763464

SCHEMBL10763464

C=CCS(=O)(=O)c1ccc(/C=C/c2ccc(=O)[nH]n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ CYP1A2 P05177 2/20 0.56
▸ HPGD P15428 2/20 0.56
▸ NPC1 O15118 2/20 0.56
▸ RAB9A P51151 2/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ POLB P06746 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ PTGS2 P35354 3/20 0.45
▸ PTGS1 P23219 2/20 0.45
▸ HTR2A P28223 3/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ PNMT P11086 1/20 0.35
▸ AKR1B1 P15121 10/20 0.34

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
SCHEMBL10763471 1.00 LMNA (0.56) LMNAKDM4ECYP1A2HPGDNPC1
SCHEMBL10764798 0.85 PTGS1 (0.56) LMNAKDM4ECYP1A2HPGDNPC1
SCHEMBL10764792 0.85 PTGS1 (0.56) LMNAKDM4ECYP1A2HPGDNPC1
SCHEMBL10762149 0.81 LMNA (0.55) LMNAKDM4ECYP1A2HPGDNPC1
SCHEMBL10762154 0.81 LMNA (0.55) LMNAKDM4ECYP1A2HPGDNPC1
SCHEMBL10761014 0.79 LMNA (0.68) LMNAKDM4ECYP1A2HPGDNPC1
SCHEMBL10761020 0.79 LMNA (0.68) LMNAKDM4ECYP1A2HPGDNPC1
SCHEMBL10760655 0.78 LMNA (0.52) LMNAKDM4ECYP1A2HPGDNPC1
SCHEMBL10762601 0.78 LMNA (0.52) LMNAKDM4ECYP1A2HPGDNPC1
SCHEMBL10762603 0.78 LMNA (0.52) LMNAKDM4ECYP1A2HPGDNPC1

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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