SCHEMBL4156728

SCHEMBL4156728

CONC(=O)c1cc2c(S(=O)(=O)N(C)CC3COCCO3)cn(Cc3ccc(F)cc3)c2cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 7/20 0.39
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MET P08581 5/20 0.37
MERTK Q12866 2/20 0.37
AURKA O14965 1/20 0.37
JAK2 O60674 1/20 0.37
ABL1 P00519 1/20 0.37
NTRK1 P04629 1/20 0.37
RET P07949 1/20 0.37
CYP3A4 P08684 1/20 0.37
PDGFRB P09619 1/20 0.37
FGFR1 P11362 1/20 0.37
CYP2C9 P11712 1/20 0.37
NQO2 P16083 1/20 0.37
FLT1 P17948 1/20 0.37
FGFR2 P21802 1/20 0.37
FGFR3 P22607 1/20 0.37
FECH P22830 1/20 0.37
FLT4 P35916 1/20 0.37

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
SCHEMBL14541884 0.90 GRM4 (0.38) GRM4LMNASMN1; SMN2METMERTK
SCHEMBL4156780 0.88 MET (0.38) GRM4LMNASMN1; SMN2METMERTK
SCHEMBL4173800 0.80 SMN1; SMN2 (0.40) LMNASMN1; SMN2MAPTTP53POLB
SCHEMBL4166906 0.79 L3MBTL1 (0.46) LMNASMN1; SMN2MAPTTP53AXL
SCHEMBL14541885 0.78 MET (0.39) GRM4LMNASMN1; SMN2METMERTK
SCHEMBL4158917 0.74 LMNA (0.40) LMNASMN1; SMN2MAPTPOLBAXL
SCHEMBL4171462 0.73 SMN1; SMN2 (0.38) LMNASMN1; SMN2MAPTTP53POLB
SCHEMBL4805963 0.71 MMP13 (0.41) MAPT
SCHEMBL4165047 0.71 SLC22A12 (0.40) GRM4LMNASMN1; SMN2
SCHEMBL1684248 0.71 HRH3 (0.44)

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
US-20090170846-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER INC 2009-07-02 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-20090170846-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME IMPDH1, IMPA1, TYMP GRM4 4799/4885LMNA 3075/4885SMN1; SMN2 3999/4885

“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.