SCHEMBL5505063

SCHEMBL5505063

CNCc1ccc(S(=O)(=O)N2CCCC2)cc1Oc1ccc(Cl)c(C)c1C

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.51
TSHR P16473 3/20 0.51
MCOLN3 Q8TDD5 1/20 0.51
KDM4E B2RXH2 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
GPBAR1 Q8TDU6 1/20 0.44
KMT2A Q03164 4/20 0.44
LMNA P02545 4/20 0.44
MEN1 O00255 3/20 0.44
MAPT P10636 2/20 0.44
HTT P42858 2/20 0.44
POLB P06746 1/20 0.44
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL5505068 0.85 ALDH1A1 (0.51) ALDH1A1TSHRMCOLN3KDM4EGPBAR1
SCHEMBL5497367 0.84 SLC6A4 (0.46)
SCHEMBL5502213 0.76 SLC6A4 (0.65)
SCHEMBL5502046 0.75 SLC6A4 (0.46)
SCHEMBL5497517 0.74 SLC6A4 (0.66)
SCHEMBL6000092 0.73 SLC6A4 (0.45)
SCHEMBL6000315 0.73 SLC6A4 (0.45)
SCHEMBL6000439 0.72 SLC6A4 (0.47)
SCHEMBL5501132 0.72 SLC6A4 (0.47)
SCHEMBL5497100 0.72 SLC6A4 (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1791807-A1 THERAPEUTIC DIPHENYL ETHER LIGANDS Pfizer Products Incorporated (US) 2007-06-06 EP claimed
WO-2006027684-A1 THERAPEUTIC DIPHENYL ETHER LIGANDS PFIZER PRODUCTS INC. (US) 2006-03-16 WO claimed
US-20060058361-A1 Therapeutic diphenyl ether ligands PFIZER INC 2006-03-16 US claimed
EP-1791807-A1 THERAPEUTIC DIPHENYL ETHER LIGANDS Pfizer Products Incorporated (US) 2007-06-06 EP disclosed
WO-2006027684-A1 THERAPEUTIC DIPHENYL ETHER LIGANDS PFIZER PRODUCTS INC. (US) 2006-03-16 WO disclosed
US-20060058361-A1 Therapeutic diphenyl ether ligands PFIZER INC 2006-03-16 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-20060058361-A1 Therapeutic diphenyl ether ligands HTR2B, HTR2C, HTR3B ALDH1A1 997/4885TSHR 1141/4885MCOLN3 3744/4885

“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.