SCHEMBL4165047

SCHEMBL4165047

CONC(=O)c1cc2c(S(=O)(=O)Nc3cccnc3OC)cn(Cc3ccc(F)cc3)c2cn1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.40
PIK3CA P42336 12/20 0.39
NAMPT P43490 2/20 0.39
GRM4 Q14833 1/20 0.38
HDAC1 Q13547 2/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GPR6 P46095 2/20 0.37
APOBEC3G Q9HC16 1/20 0.36

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
SCHEMBL1684266 0.89 SLC22A12 (0.40) SLC22A12PIK3CANAMPTGRM4SMN1; SMN2
SCHEMBL4171462 0.80 SMN1; SMN2 (0.38) LMNASMN1; SMN2
SCHEMBL4173800 0.79 SMN1; SMN2 (0.40) LMNASMN1; SMN2
SCHEMBL4166906 0.76 L3MBTL1 (0.46) LMNASMN1; SMN2
SCHEMBL4163667 0.73 MEN1 (0.42)
SCHEMBL4166922 0.73 MEN1 (0.40) LMNA
SCHEMBL4162951 0.73 SMN1; SMN2 (0.42) LMNASMN1; SMN2
SCHEMBL4805963 0.73 MMP13 (0.41)
SCHEMBL4810125 0.71 THRB (0.40)
SCHEMBL4156728 0.71 GRM4 (0.39) GRM4LMNASMN1; SMN2

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
US-20090170846-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER INC 2009-07-02 US claimed
US-20090170846-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER INC 2009-07-02 US disclosed
US-20090170846-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER INC 2009-07-02 US disclosed
WO-2007039802-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER PRODUCTS INC. (US) 2007-04-12 WO 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-20090170846-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME IMPDH1, IMPA1, TYMP SLC22A12 2885/4885PIK3CA 180/4885NAMPT 417/4885

“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.