SCHEMBL6317449

SCHEMBL6317449

O=C(C=Cc1ccccc1)NCC1Cc2c(sc(NC(=O)C(=O)O)c2C(=O)O)CO1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
PTPN1 P18031 11/20 0.45
FLT3 P36888 1/20 0.44
PTPN2 P17706 5/20 0.43
PTPRC P08575 2/20 0.43
PTPRB P23467 2/20 0.43
PTPRE P23469 2/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
RAB7A P51149 2/20 0.42
PTPN6 P29350 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL6316945 0.92 PTPN1 (0.45) MAPTNPC1RAB9ANPSR1PTPN1
SCHEMBL6315775 0.90 NPC1 (0.41) MAPTNPC1RAB9ANPSR1PTPN1
SCHEMBL6322712 0.89 PTPN1 (0.41) MAPTNPC1RAB9ANPSR1PTPN1
SCHEMBL6323701 0.88 RAB7A (0.46) MAPTNPC1RAB9ANPSR1PTPN1
SCHEMBL6314280 0.88 KMT2A (0.55) MAPTNPC1RAB9ANPSR1PTPN1
SCHEMBL6314369 0.88 MAPT (0.57) MAPTNPC1RAB9ANPSR1PTPN1
SCHEMBL6315924 0.86 PTPN1 (0.40) MAPTNPC1RAB9ANPSR1PTPN1
SCHEMBL6318337 0.86 PTPN1 (0.47) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL6316673 0.85 PTPN1 (0.46) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL6206528 0.84 RAB7A (0.55) MAPTNPC1RAB9APTPN1PTPN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030069267-A1 Modulators of protein tyrosine phosphatases (PTPases) MOLLER NIELS PETER HUNDAHL (DK) 2003-04-10 US claimed
US-6410586-B1 ANTICOAGULANTS; INSULIN RESISTANCE; ANTIALLERGENS NOVO NORDISK A/S (DK) 2002-06-25 US claimed
US-6951878-B2 Benzo[b]thiophenyl or tetrahydro-benzo[b]thiophenyl modulators of protein tyrosine phosphatases (PTPases) NOVO NORDISK A/S (DK) 2005-10-04 US disclosed
US-20030069267-A1 Modulators of protein tyrosine phosphatases (PTPases) MOLLER NIELS PETER HUNDAHL (DK) 2003-04-10 US disclosed
US-6262044-B1 CONTAINING AN AMIDE-SUBSTITUTED TETRAHYDROTHIENOPYRIDINE RING NOVO NORDISK A/S (DK) 2001-07-17 US disclosed
EP-1080095-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 2001-03-07 EP disclosed
WO-1999046267-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 1999-09-16 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-20030069267-A1 Modulators of protein tyrosine phosphatases (PTPases) PTPRCAP, PTPRS, PTPRA MAPT 475/4885NPC1 3245/4885RAB9A 2751/4885

“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.