SCHEMBL7524893

SCHEMBL7524893

COc1ccc(CN2Cc3sc(NC(=O)C(=O)O)c(C(=O)O)c3CC2CNC(=O)C=Cc2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.45
PTPN2 P17706 6/20 0.45
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
MAPT P10636 5/20 0.41
FLT3 P36888 1/20 0.41
TP53 P04637 2/20 0.41
ALDH1A1 P00352 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HPGD P15428 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
POLB P06746 1/20 0.41
THRB P10828 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 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
SCHEMBL7694698 0.86 BCHE (0.40) BCHEACHEMAPTFLT3TP53
SCHEMBL7736217 0.83 PTPN1 (0.43) PTPN1PTPN2BCHEACHEMAPT
SCHEMBL7522308 0.81 GLO1 (0.46) PTPN1PTPN2MAPTTP53ALDH1A1
SCHEMBL7521500 0.78 PTPN1 (0.43) PTPN1PTPN2ALDH1A1KMT2AKDM4E
SCHEMBL5837948 0.78 PTPN1 (0.49) PTPN1PTPN2
SCHEMBL5838091 0.78 PTPN1 (0.53) PTPN1PTPN2
SCHEMBL7519093 0.76 PTPN1 (0.46) PTPN1PTPN2MAPTFLT3ALDH1A1
SCHEMBL7519972 0.76 PTPN1 (0.44) PTPN1PTPN2MAPTMEN1KMT2A
SCHEMBL5837745 0.74 PTPN1 (0.44) PTPN1PTPN2MAPTMEN1KMT2A
SCHEMBL7521290 0.73 PTPN1 (0.54) PTPN1PTPN2BCHEKMT2ANPC1

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 2 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
US-20020099073-A1 Modulators of protein tyrosine phosphatases (PTPases) NOVO NORDISK A/S (DK) 2002-07-25 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-20020099073-A1 Modulators of protein tyrosine phosphatases (PTPases) PTPN1, PTPRO, PTPRS PTPN1 1/4885PTPN2 14/4885BCHE 2703/4885

“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.