SCHEMBL9678883

SCHEMBL9678883

Cc1ccc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2c(F)cc(F)cc2F)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MMP9 P14780 5/20 0.56
▸ MMP2 P08253 5/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ THRB P10828 1/20 0.54
▸ CTSL P07711 1/20 0.52
▸ POLB P06746 2/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ ADAMTS4 O75173 1/20 0.51
▸ NPY5R Q15761 2/20 0.51
▸ USP30 Q70CQ3 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ PLAU P00749 1/20 0.49
▸ HPN P05981 1/20 0.49

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
SCHEMBL9680638 0.82 NLRP3 (0.58) MMP9MMP2SMN1; SMN2THRBCTSL
SCHEMBL13957019 0.81 MMP9 (0.66) MMP9MMP2SMN1; SMN2THRBCTSL
SCHEMBL30950303 0.79 MMP9 (0.64) MMP9MMP2CTSLPOLBTDP1
SCHEMBL697477 0.79 MMP2 (0.79) MMP9MMP2CTSLPOLBTDP1
SCHEMBL1203540 0.79 MMP2 (0.79) MMP9MMP2CTSLPOLBTDP1
SCHEMBL697476 0.79 MMP2 (0.79) MMP9MMP2CTSLPOLBTDP1
Hydrochloric Acid SCHEMBL3839410 0.78 MMP2 (0.77) MMP9MMP2CTSLPOLBTDP1
SCHEMBL14544569 0.78 MMP9 (0.65) MMP9MMP2CTSLPOLBTDP1
SCHEMBL13750427 0.78 MMP9 (0.65) MMP9MMP2CTSLPOLBTDP1
Hydrochloric Acid SCHEMBL11133046 0.78 MMP2 (0.77) MMP9MMP2CTSLPOLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0415413-A1 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-03-06 — — EP claimed
US-5153226-A Administering as anticholesterol agents, for atherosclerosis WARNER-LAMBERT COMPANY (US) 1992-10-06 — — US disclosed
EP-0415413-A1 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-03-06 — — EP disclosed
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