SCHEMBL5863722

SCHEMBL5863722

Cc1cc(C)c(S(=O)(=O)N(Cc2cccc(O)c2)c2ccc(C=CC(=O)NCc3cccc(-c4ccccc4)c3)cc2)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 5/20 0.47
MMP2 P08253 5/20 0.47
MMP9 P14780 5/20 0.47
POLB P06746 1/20 0.42
GPR55 Q9Y2T6 1/20 0.42
SENP1 Q9P0U3 3/20 0.40
SENP2 Q9HC62 1/20 0.40
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
ACHE P22303 1/20 0.38
HSD17B1 P14061 1/20 0.38

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
SCHEMBL5863717 1.00 MMP1 (0.47) MMP1MMP2MMP9POLBGPR55
SCHEMBL5863735 0.84 AKR1C3 (0.41) GPR55KEAP1NFE2L2LMNA
SCHEMBL5863737 0.84 AKR1C3 (0.41) GPR55KEAP1NFE2L2LMNA
SCHEMBL5863833 0.84 GPR55 (0.42) MMP1MMP2MMP9GPR55KEAP1
SCHEMBL5863828 0.84 GPR55 (0.42) MMP1MMP2MMP9GPR55KEAP1
SCHEMBL5864472 0.83 TDP1 (0.47) MMP1MMP2MMP9POLBGPR55
SCHEMBL5864476 0.83 TDP1 (0.47) MMP1MMP2MMP9POLBGPR55
SCHEMBL5864468 0.83 TDP1 (0.47) MMP1MMP2MMP9POLBGPR55
SCHEMBL5864173 0.82 NR1H4 (0.48) GPR55KEAP1
SCHEMBL5864174 0.82 NR1H4 (0.48) GPR55KEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7053212-B2 Acyclic amide and sulfonamide ligands for the estrogen receptor PFIZER INC. (US) 2006-05-30 US disclosed
US-20040110767-A1 Acyclic amide and sulfonamide ligands for the estrogen receptor PFIZER INC 2004-06-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040110767-A1 Acyclic amide and sulfonamide ligands for the estrogen receptor GHSR, GPER1, SSTR1 MMP1 1746/4885MMP2 1702/4885MMP9 2415/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.