SCHEMBL7560915

SCHEMBL7560915

C[C@@H](c1ccccc1)N1CCc2c(sc(N)c2C(=O)OC(C)(C)C)C1CN

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM6 O15303 1/20 0.41
ADORA1 P30542 9/20 0.39
MAPT P10636 3/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
CXCR2 P25025 4/20 0.36
GAA P10253 2/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 2/20 0.34
NT5E P21589 1/20 0.34
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
GLA P06280 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL5766514 1.00 GRM6 (0.41) GRM6ADORA1MAPTMEN1LMNA
SCHEMBL5768050 1.00 GRM6 (0.41) GRM6ADORA1MAPTMEN1LMNA
SCHEMBL5766511 1.00 GRM6 (0.41) GRM6ADORA1MAPTMEN1LMNA
SCHEMBL5770902 1.00 GRM6 (0.41) GRM6ADORA1MAPTMEN1LMNA
SCHEMBL6999013 0.87 ADORA1 (0.43) ADORA1MAPTMEN1LMNAKMT2A
SCHEMBL5838542 0.87 ADORA1 (0.43) ADORA1MAPTMEN1LMNAKMT2A
SCHEMBL5768503 0.87 GRM6 (0.37) GRM6ADORA1MAPTMEN1LMNA
SCHEMBL5768500 0.87 GRM6 (0.37) GRM6ADORA1MAPTMEN1LMNA
SCHEMBL5769847 0.87 GRM6 (0.37) GRM6ADORA1MAPTMEN1LMNA
SCHEMBL5837158 0.85 ADORA1 (0.38) GRM6ADORA1MAPTMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020151561-A1 Modulators of Protein Tyrosine Phosphatases (PTPases) NOVO NORDISK A/S (DK) 2002-10-17 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-20020151561-A1 Modulators of Protein Tyrosine Phosphatases (PTPases) PTPRO, PTPN1, PTPRS GRM6 2745/4885ADORA1 1290/4885MAPT 4142/4885

“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.