SCHEMBL5926744

SCHEMBL5926744

O=C(Nc1ccc(Cl)cc1C(=O)N[C@@H](Cc1ccc(-c2ccccc2Oc2ccccc2)cc1)C(=O)O)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SERPINE1 P05121 2/20 0.56
▸ LMNA P02545 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ PTPN1 P18031 1/20 0.47
▸ GPR34 Q9UPC5 3/20 0.46
▸ ITGB1 P05556 2/20 0.44
▸ ITGA4 P13612 2/20 0.44
▸ ITGB7 P26010 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL5926815 0.94 GPR34 (0.55) SERPINE1PTPN1GPR34
SCHEMBL3995385 0.93 GPR132 (0.48) SERPINE1PTPN1
SCHEMBL5926197 0.93 SERPINE1 (0.49) SERPINE1LMNASMN1; SMN2L3MBTL1PTPN1
SCHEMBL5927527 0.93 SERPINE1 (0.52) SERPINE1LMNASMN1; SMN2L3MBTL1PTPN1
SCHEMBL5926619 0.91 ITGA4 (0.47) SERPINE1LMNAL3MBTL1GPR34ITGB1
SCHEMBL5927167 0.91 GPR132 (0.51) SERPINE1PTPN1GPR34
SCHEMBL5926762 0.91 ITGB1 (0.44) SERPINE1ITGB1ITGA4ITGB7
SCHEMBL5926528 0.91 SERPINE1 (0.50) SERPINE1LMNASMN1; SMN2L3MBTL1PTPN1
SCHEMBL5926633 0.90 SERPINE1 (0.45) SERPINE1LMNASMN1; SMN2L3MBTL1PTPN1
SCHEMBL5927230 0.90 GRN (0.47) SERPINE1LMNASMN1; SMN2L3MBTL1GPR34

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-20060276518-A1 Aryl and heteroaryl compounds and methods to modulate coagulation TRANSTECH PHARMA, INC. 2006-12-07 — — US disclosed
US-7122580-B2 Aryl and heteroaryl compounds and methods to modulate coagulation TRANSTECH PHARMA, INC. (US) 2006-10-17 — — 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-20060276518-A1 Aryl and heteroaryl compounds and methods to modulate coagulation TFPI, F9, F2 SERPINE1 27/4885LMNA 178/4885SMN1; SMN2 2773/4885

“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.

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