SCHEMBL7372002

SCHEMBL7372002

Cc1c(CC=O)n(S(=O)(=O)c2ccccc2)c2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PCSK9 Q8NBP7 4/20 0.52
▸ AGTR1 P30556 3/20 0.49
▸ HTR6 P50406 8/20 0.43
▸ PTGDR2 Q9Y5Y4 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ UBE2N P61088 1/20 0.40
▸ PSEN1 P49768 1/20 0.40
▸ PSEN2 P49810 1/20 0.40
▸ APH1B Q8WW43 1/20 0.40
▸ NCSTN Q92542 1/20 0.40
▸ APH1A Q96BI3 1/20 0.40
▸ PSENEN Q9NZ42 1/20 0.40
▸ PTGDR Q13258 1/20 0.39

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
SCHEMBL7378048 0.81 AGTR1 (0.55) PCSK9AGTR1HTR6PTGDR2PSEN1
SCHEMBL19605706 0.77 HTR6 (0.50) PCSK9AGTR1HTR6PTGDR2PTGDR
SCHEMBL7192965 0.77 AGTR1 (0.55) PCSK9AGTR1HTR6
SCHEMBL9588666 0.76 PCSK9 (0.48) PCSK9AGTR1HTR6PSEN1PSEN2
SCHEMBL17521604 0.76 PCSK9 (0.87) PCSK9AGTR1HTR6
SCHEMBL4312597 0.75 PSEN1 (0.49) HTR6KDM4EPSEN1PSEN2APH1B
SCHEMBL12093313 0.73 HTR6 (0.70) HTR6PSEN1PSEN2APH1BNCSTN
SCHEMBL12496512 0.72 AGTR1 (0.47) PCSK9AGTR1HTR6
SCHEMBL17521607 0.72 PCSK9 (0.58) PCSK9AGTR1HTR6
SCHEMBL27885302 0.71 HTR6 (0.50) AGTR1HTR6PSEN1PSEN2APH1B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0420086-B1 Pyrimidoindole derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1995-12-13 — — EP disclosed
US-5256780-A Serotonin antagonist FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-10-26 — — US disclosed
US-5180728-A Antagonists of 5-hydroxytryptamine FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1993-01-19 — — US disclosed
EP-0420086-A2 Pyrimidoindole derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-04-03 — — EP disclosed
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