SCHEMBL4757376

SCHEMBL4757376

COc1cc(Nc2ncc(-c3ccccc3CN(C)C(=O)CN)o2)ccc1-c1cnco1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 20/20 0.70

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
SCHEMBL6179857 0.92 IMPDH2 (0.61) IMPDH2
SCHEMBL6182668 0.91 IMPDH2 (0.60) IMPDH2
SCHEMBL5012543 0.88 IMPDH2 (0.86) IMPDH2
SCHEMBL6179758 0.87 IMPDH2 (0.51) IMPDH2
SCHEMBL6180740 0.86 IMPDH2 (0.52) IMPDH2
SCHEMBL1473908 0.83 IMPDH2 (0.73) IMPDH2
SCHEMBL6179213 0.82 VCP (0.49) IMPDH2
SCHEMBL1475417 0.82 IMPDH2 (1.00) IMPDH2
SCHEMBL1473135 0.82 IMPDH2 (1.00) IMPDH2
SCHEMBL1474502 0.82 IMPDH2 (1.00) IMPDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1532103-A4 USE OF COMPOUNDS HAVING AN AMINE NUCLEUS IN MANUFACTURE OF A MEDICAMENT USEFUL FOR TREATING FACTOR VIIA-ASSOCIATED CONDITIONS BRISTOL MYERS SQUIBB CO (US) 2008-03-05 EP disclosed
US-20060173057-A1 Methods of treating factor VIIa-associated conditions with compounds having an amine nucleus HERPIN TIMOTHY 2006-08-03 US disclosed
US-7041692-B2 Methods of treating factor VIIa-associated conditions with compounds having an amine nucleus BRISTOL-MYERS SQUIBB COMPANY (US) 2006-05-09 US disclosed
EP-1532103-A2 USE OF COMPOUNDS HAVING AN AMINE NUCLEUS IN MANUFACTURE OF A MEDICAMENT USEFUL FOR TREATING FACTOR VIIA-ASSOCIATED CONDITIONS Bristol-Myers Squibb Company (US) 2005-05-25 EP disclosed
US-20040029940-A1 Methods of treating factor VIIa-associated conditions with compounds having an amine nucleus BRISTOL-MYERS SQUIBB COMPANY 2004-02-12 US disclosed
WO-2004000214-A2 USE OF COMPOUNDS HAVING AN AMINE NUCLEUS IN MANUFACTURE OF A MEDICAMENT USEFUL FOR TREATING FACTOR VIIA-ASSOCIATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-12-31 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 (2 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-20060173057-A1 Methods of treating factor VIIa-associated conditions with compounds having an amine nucleus F7, F8, F13B IMPDH2 2015/4885
US-20040029940-A1 Methods of treating factor VIIa-associated conditions with compounds having an amine nucleus F7, F8, F13B IMPDH2 1977/4885

“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.