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Sugi Predict / Compounds / SCHEMBL6375292

SCHEMBL6375292

SCHEMBL6375292

CCCCC(NC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(OC)c(OC)c1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.59
▸ LMNA P02545 1/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ USP2 O75604 1/20 0.58
▸ GAA P10253 1/20 0.58
▸ MMP8 P22894 13/20 0.54
▸ MMP3 P08254 6/20 0.54
▸ MAPT P10636 3/20 0.51

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
SCHEMBL6368940 1.00 TP53 (0.59) TP53LMNASMN1; SMN2USP2GAA
SCHEMBL6373299 0.91 TP53 (0.60) TP53LMNASMN1; SMN2USP2GAA
SCHEMBL6368197 0.91 TP53 (0.64) TP53LMNASMN1; SMN2USP2GAA
SCHEMBL6367804 0.90 TP53 (0.56) TP53LMNASMN1; SMN2USP2GAA
SCHEMBL6368668 0.90 TP53 (0.59) TP53LMNASMN1; SMN2USP2GAA
SCHEMBL6368442 0.90 TP53 (0.59) TP53LMNASMN1; SMN2USP2GAA
SCHEMBL6375672 0.89 TP53 (0.59) TP53LMNASMN1; SMN2USP2GAA
SCHEMBL6369048 0.89 TP53 (0.55) TP53LMNASMN1; SMN2USP2GAA
SCHEMBL6451639 0.89 MMP8 (0.63) SMN1; SMN2MMP8MMP3MAPT
SCHEMBL6368875 0.88 TP53 (0.61) TP53LMNASMN1; SMN2USP2GAA

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
US-6903075-B1 Heterocyclic amide compounds as cell adhesion inhibitors MERCK & CO., INC. (US) 2005-06-07 — — US claimed