SCHEMBL631155

SCHEMBL631155

CSc1cccc(-c2ccc3cc(OCc4ccccc4)c(N4CC(=O)NS4(=O)=O)cc3c2)c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.51
PTGER1 P34995 1/20 0.36
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
LMNA P02545 1/20 0.33
PTP4A3 O75365 2/20 0.33
FFAR1 O14842 2/20 0.32
PPARD Q03181 2/20 0.32
SLC6A4 P31645 1/20 0.32
CYP19A1 P11511 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
PIK3CG P48736 1/20 0.32
PTPN2 P17706 1/20 0.32
MGLL Q99685 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
SCHEMBL630626 0.87 PTPN1 (0.51) PTPN1CTSLCTSBPTP4A3FFAR1
SCHEMBL629669 0.85 PTPN1 (0.49) PTPN1PTGER1FFAR1PPARD
SCHEMBL629847 0.83 PTPN1 (0.49) PTPN1FFAR1PPARDMGLL
SCHEMBL629597 0.83 PTPN1 (0.47) PTPN1FFAR1PPARD
SCHEMBL3005189 0.82 PTPN1 (0.48) PTPN1PTPN2
SCHEMBL629774 0.81 PTPN1 (0.51) PTPN1PTPN2
Potassium SCHEMBL629775 0.81 PTPN1 (0.51) PTPN1PTPN2
SCHEMBL2998204 0.81 PTPN1 (0.61) PTPN1CTSLCTSBPTPN2
Potassium SCHEMBL2998210 0.81 PTPN1 (0.61) PTPN1CTSLCTSBPTPN2
SCHEMBL629591 0.81 PTPN1 (0.46) PTPN1CTSLCTSBPTP4A3CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963292-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2012-02-22 EP disclosed
US-7700633-B2 Organic compounds NOVARTIS AG (CH) 2010-04-20 US disclosed
US-20080262050-A1 Organic Compounds NOVARTIS AG (CH) 2008-10-23 US disclosed
EP-1963292-A2 ORGANIC COMPOUNDS Novartis Pharma AG (CH) 2008-09-03 EP disclosed
WO-2007067615-A2 THIADIAZOLE DERIVATIVES AS ANTIDIABETIC AGENTS NOVARTIS AG (CH) 2007-06-14 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-20080262050-A1 Organic Compounds PTPRS, PTPRO, PTPRC PTPN1 23/4885PTGER1 1095/4885CTSL 3599/4885

“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.