SCHEMBL4717324

SCHEMBL4717324

Cc1ccc(S(=O)(=O)OC[C@H](O)[C@H](c2ccccc2)n2ccc3cc(NC(=O)c4ccc(C)c(Cl)c4)ccc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.41
SLC6A2 P23975 4/20 0.41
SLC6A4 P31645 4/20 0.41
ENPP2 Q13822 1/20 0.41
MAPT P10636 5/20 0.40
LMNA P02545 3/20 0.40
POLB P06746 1/20 0.39
MAOB P27338 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
THRB P10828 1/20 0.38
CNR1 P21554 1/20 0.38
TP53 P04637 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
SCHEMBL4717325 1.00 PPARG (0.41) PPARGSLC6A2SLC6A4ENPP2MAPT
SCHEMBL4721654 1.00 PPARG (0.41) PPARGSLC6A2SLC6A4ENPP2MAPT
SCHEMBL4871187 0.91 SLC6A2 (0.42) PPARGSLC6A2SLC6A4ENPP2MAPT
SCHEMBL4871195 0.91 SLC6A2 (0.42) PPARGSLC6A2SLC6A4ENPP2MAPT
SCHEMBL4871208 0.91 SLC6A2 (0.42) PPARGSLC6A2SLC6A4ENPP2MAPT
SCHEMBL4719760 0.90 SLC6A2 (0.45) PPARGSLC6A2SLC6A4ENPP2MAPT
SCHEMBL4719767 0.90 SLC6A2 (0.45) PPARGSLC6A2SLC6A4ENPP2MAPT
SCHEMBL4719765 0.90 SLC6A2 (0.45) PPARGSLC6A2SLC6A4ENPP2MAPT
SCHEMBL4721821 0.89 SLC6A2 (0.45) PPARGSLC6A2SLC6A4ENPP2MAPT
SCHEMBL4791080 0.89 SLC6A2 (0.45) PPARGSLC6A2SLC6A4ENPP2MAPT

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-1931631-A1 1- (1H- INDOL- 1-YL) -3- (METHYLAMINO) -1- PHENYLPROPAN-2-OL DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS OF THE MONOAMINE REUPTAKE FOR THE TREATMENT OF VASOMOTOR SYMPTOMS (VMS) Wyeth a Corporation of the State of Delaware (US) 2008-06-18 EP disclosed
WO-2007041023-A1 1- (1H- INDOL- 1-YL) -3- (METHYLAMINO) -1- PHENYLPROPAN-2-OL DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS OF THE MONOAMINE REUPTAKE FOR THE TREATMENT OF VASOMOTOR SYMPTOMS (VMS) WYETH (US) 2007-04-12 WO disclosed
US-20070072897-A1 Phenylaminopropanol derivatives and methods of their use WYETH (US) 2007-03-29 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 (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-20070072897-A1 Phenylaminopropanol derivatives and methods of their use COMT, PNMT, GLS PPARG 498/4885SLC6A2 8/4885SLC6A4 16/4885

“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.