SCHEMBL5163073

SCHEMBL5163073

COC(=O)c1cc(-c2ccc(CN(Cc3ccc(C(F)(F)P(=O)(O)O)c(Cl)c3)S(=O)(=O)c3ccccc3OC)cc2)ccc1OC

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 12/20 0.45
LMNA P02545 3/20 0.41
MAPT P10636 2/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.40
TP53 P04637 2/20 0.39
PTPN2 P17706 1/20 0.39
NR1H4 Q96RI1 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
SCHEMBL5166571 0.93 PTPN1 (0.47) PTPN1LMNAMAPTHTTNPSR1
SCHEMBL5164813 0.88 PTPN1 (0.53) PTPN1ALDH1A1PTPN2
SCHEMBL5164528 0.87 PTPN1 (0.45) PTPN1LMNAMAPTHTTNPSR1
SCHEMBL5166610 0.86 PTPN1 (0.43) PTPN1LMNAMAPTALDH1A1TP53
SCHEMBL5164627 0.86 PTPN1 (0.44) PTPN1LMNAMAPTHTTNPSR1
SCHEMBL5163077 0.85 LMNA (0.40) PTPN1LMNAMAPTHTTNPSR1
SCHEMBL5165866 0.85 PTPN1 (0.48) PTPN1ALDH1A1PTPN2
SCHEMBL5188999 0.84 LMNA (0.40) PTPN1LMNAHPGDNR1H4
SCHEMBL5167003 0.84 PTPN5 (0.45) PTPN1PTPN2
SCHEMBL5166033 0.82 PTPN1 (0.45) PTPN1ALDH1A1TP53PTPN2

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-1765332-A2 TRISUBSTITUTED NITROGEN MODULATORS OF TYROSINE PHOSPHATASES Cengent Therapeutics, Inc. (US) 2007-03-28 EP disclosed
US-20060135773-A1 Trisubstituted nitrogen modulators of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-06-22 US disclosed
WO-2006009876-A2 TRISUBSTITUTED NITROGEN MODULATORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-01-26 WO 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-20060135773-A1 Trisubstituted nitrogen modulators of tyrosine phosphatases PTPA, PTPN1, PTPRS PTPN1 2/4885LMNA 4794/4885MAPT 3572/4885

“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.