SCHEMBL5505035

SCHEMBL5505035

CS(=O)(=O)c1ccc(CCN)c(Oc2ccc3ccccc3c2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.44
SOS1 Q07889 1/20 0.42
ATM Q13315 1/20 0.42
PLA2G7 Q13093 3/20 0.42
GAA P10253 2/20 0.41
HRH1 P35367 1/20 0.41
RCE1 Q9Y256 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 1/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PTGS2 P35354 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
AGXT P21549 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
SCHEMBL5505033 0.82 HTR2A (0.47) ATM
SCHEMBL5998731 0.82 PTGS1 (0.48) HTR6SOS1PTGS2CA1CA2
SCHEMBL5999367 0.82 PRKCI (0.39) HTR6SOS1LMNA
SCHEMBL5503713 0.82 SOS1 (0.49) SOS1HRH1HTTSMN1; SMN2PTGS2
SCHEMBL5503825 0.81 BRD4 (0.45) HTR6SOS1L3MBTL1LMNASMN1; SMN2
SCHEMBL5497370 0.72 SOS1 (0.41) HTR6SOS1LMNASMN1; SMN2PTGS2
SCHEMBL758323 0.71 ATM (0.66) ATMGAAL3MBTL1LMNAPTGS2
SCHEMBL5502051 0.69 SOS1 (0.44) SOS1LMNAPTGS2
SCHEMBL5998727 0.67 PTGS1 (0.48) PTGS2
SCHEMBL5999361 0.66 HTR2A (0.42) LMNA

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 HTR6 13/4885SOS1 3837/4885ATM 1852/4885

“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.