SCHEMBL4036738

SCHEMBL4036738

CN(C)Cc1ccc(CNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3ccccc3C(F)(F)F)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 5/20 0.47
POLB P06746 4/20 0.42
LMNA P02545 2/20 0.41
HTT P42858 2/20 0.40
RECQL P46063 1/20 0.40
EPHX2 P34913 1/20 0.40
SCN10A Q9Y5Y9 1/20 0.40
HTR1A P08908 1/20 0.39
DRD2 P14416 1/20 0.39
HTR7 P34969 1/20 0.39
HTR6 P50406 1/20 0.39
CNR2 P34972 1/20 0.39
ATM Q13315 1/20 0.39
KDM2B Q8NHM5 1/20 0.38
FKBP1A P62942 1/20 0.38
GAA P10253 1/20 0.38
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP14 P50281 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
SCHEMBL4038373 0.91 SCN9A (0.46) SCN9APOLBLMNAHTTRECQL
SCHEMBL4832648 0.89 SCN9A (0.48) SCN9APOLBLMNAHTTRECQL
SCHEMBL4842829 0.89 SCN9A (0.48) SCN9APOLBLMNAHTTRECQL
SCHEMBL4836962 0.88 SCN9A (0.46) SCN9APOLBLMNAHTTRECQL
SCHEMBL4035693 0.86 TRPA1 (0.41) SCN9ALMNAKDM2B
SCHEMBL4039819 0.85 MAPK1 (0.40) SCN9ALMNAKDM2BMMP1MMP2
SCHEMBL4840756 0.84 SCN9A (0.45) SCN9APOLBLMNAHTTRECQL
SCHEMBL4039147 0.84 RORC (0.42) SCN9ALMNAKDM2BMMP1MMP2
SCHEMBL4834117 0.84 SCN9A (0.44) SCN9APOLBLMNAHTTRECQL
SCHEMBL4034006 0.82 MMP1 (0.40) SCN9ALMNAKDM2BMMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1885695-B1 INDOLINE COMPOUNDS FOURNIER LAB SA (FR) 2009-02-25 EP disclosed
US-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 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-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 SCN9A 1845/4885POLB 4775/4885LMNA 1943/4885

“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.