SCHEMBL7525515

SCHEMBL7525515

O=C(O)C(=O)Nc1sc2c(c1C(=O)O)C[C@@H](CNC(=O)c1cccc(Oc3ccccc3)c1)NC2

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.45
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
NOD1 Q9Y239 1/20 0.43
PTPN1 P18031 6/20 0.40
PTPN2 P17706 3/20 0.40
PTPRC P08575 1/20 0.40
NPC1 O15118 5/20 0.39
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
MAPT P10636 2/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL7519532 0.90 PTPN1 (0.47) RAB9AMEN1KMT2ANOD1PTPN1
SCHEMBL7520917 0.88 PTPN1 (0.42) RAB9AMEN1KMT2ANOD1PTPN1
SCHEMBL7513085 0.87 PTPN1 (0.47) RAB9AKMT2APTPN1PTPN2PTPRC
SCHEMBL7513118 0.85 PTPN1 (0.41) PTPN1PTPN2PTPRC
SCHEMBL7519819 0.84 RAB9A (0.44) RAB9AMEN1KMT2ANOD1PTPN1
SCHEMBL7517024 0.84 RAB9A (0.44) RAB9AMEN1KMT2ANOD1PTPN1
SCHEMBL7522183 0.84 PTPN1 (0.46) RAB9AMEN1KMT2ANOD1PTPN1
SCHEMBL7520464 0.83 PTPN1 (0.44) RAB9AMEN1KMT2ANOD1PTPN1
SCHEMBL5837619 0.82 PTPN1 (0.42) PTPN1PTPN2PTPRC
SCHEMBL7520327 0.81 PTPN1 (0.43) RAB9APTPN1PTPN2PTPRCNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020099073-A1 Modulators of protein tyrosine phosphatases (PTPases) NOVO NORDISK A/S (DK) 2002-07-25 US claimed
WO-2002004458-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 2002-01-17 WO claimed
US-20020099073-A1 Modulators of protein tyrosine phosphatases (PTPases) NOVO NORDISK A/S (DK) 2002-07-25 US disclosed
WO-2002004458-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 2002-01-17 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-20020099073-A1 Modulators of protein tyrosine phosphatases (PTPases) PTPN1, PTPRO, PTPRS RAB9A 3157/4885MEN1 4795/4885KMT2A 3426/4885

“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.