SCHEMBL9668567

SCHEMBL9668567

O=C(NCCN1CCC(OC(c2ccc(F)cc2)c2ccc(F)cc2)CC1)C1CSC(c2cccnc2)N1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 2/20 0.49
▸ PTAFR P25105 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ BCHE P06276 2/20 0.42

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
SCHEMBL9668575 1.00 SLC6A3 (0.49) SLC6A3PTAFRKDM4EALDH1A1BCHE
SCHEMBL9249258 0.95 PTAFR (0.48) SLC6A3PTAFRKDM4EALDH1A1BCHE
SCHEMBL9249252 0.95 PTAFR (0.48) SLC6A3PTAFRKDM4EALDH1A1BCHE
SCHEMBL9258510 0.85 PTAFR (0.50) PTAFRKDM4EALDH1A1
SCHEMBL9258514 0.85 PTAFR (0.50) PTAFRKDM4EALDH1A1
SCHEMBL9278556 0.82 PTAFR (0.47) PTAFRKDM4EALDH1A1
SCHEMBL9253936 0.81 PTAFR (0.53) PTAFRKDM4EALDH1A1
SCHEMBL9253939 0.81 PTAFR (0.53) PTAFRKDM4EALDH1A1
SCHEMBL9249978 0.80 PTAFR (0.48) PTAFRKDM4EALDH1A1
SCHEMBL9249976 0.80 PTAFR (0.48) PTAFRKDM4EALDH1A1

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-0463873-A1 Thiazolidinecarboxylic acid amide derivatives having anti-allergic activity, their preparation and their use Sankyo Company Limited (JP) 1992-01-02 — — EP disclosed
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