SCHEMBL4895531

SCHEMBL4895531

Cc1sc(-c2ccc(F)c(Cl)c2)nc1CCO

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.41
TRPV3 Q8NET8 1/20 0.40
DCK P27707 3/20 0.39
BCHE P06276 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
SHMT1 P34896 1/20 0.38
SHMT2 P34897 1/20 0.38
ABL1 P00519 1/20 0.38
PTGS2 P35354 2/20 0.37
PPARG P37231 2/20 0.37
PPARA Q07869 2/20 0.37
CHRM4 P08173 1/20 0.36
NISCH Q9Y2I1 1/20 0.36
MGLL Q99685 1/20 0.35

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
SCHEMBL16399348 0.89 APEX1 (0.43) APEX1TRPV3DCKBCHETP53
SCHEMBL4907063 0.88 DCK (0.43) APEX1TRPV3DCKBCHETP53
SCHEMBL3372455 0.83 APEX1 (0.47) APEX1MAPTPPARGPPARA
SCHEMBL6602368 0.80 DCK (0.53) DCKTP53MAPTPPARGPPARA
SCHEMBL4905599 0.79 PTPN11 (0.43) MAPTSHMT1SHMT2ABL1
SCHEMBL5266180 0.79 TRPV3 (0.36) APEX1TRPV3DCKBCHETP53
SCHEMBL3370684 0.78 PPARA (0.47) DCKMAPTPPARGPPARA
SCHEMBL820915 0.77 PPARA (0.49) DCKPPARGPPARA
SCHEMBL18003121 0.77 DCK (0.48) TRPV3DCKTP53MAPT
SCHEMBL4906632 0.77 PPARG (0.39) DCKPPARGPPARA

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
CN-101287718-A Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER PROD INC (US) 2008-10-15 CN disclosed
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER INC. 2008-04-17 US disclosed
US-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds HAMANAKA ERNEST S 2006-10-12 US disclosed
US-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER INC 2005-12-29 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 (3 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-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds PPARA, PPARG, PPARD APEX1 3429/4885TRPV3 3691/4885DCK 3882/4885
US-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PPARA, PPARG, PPARD APEX1 3771/4885TRPV3 3713/4885DCK 3976/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD APEX1 3771/4885TRPV3 3713/4885DCK 3976/4885

“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.