SCHEMBL4484461

SCHEMBL4484461

Cc1ccc(C(=O)N(C)c2cncc(C(C)(C)C)c2)cc1-n1cc(C(=O)O)cn1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRAF P15056 9/20 0.40
ABL1 P00519 5/20 0.38
BCR P11274 5/20 0.38
EGLN1 Q9GZT9 2/20 0.38
GPBAR1 Q8TDU6 1/20 0.36
HPGDS O60760 1/20 0.35
ALKBH2 Q6NS38 1/20 0.35

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
SCHEMBL4473159 0.85 BRAF (0.44) BRAF
SCHEMBL4482580 0.81 KDM4E (0.34) BRAFABL1GPBAR1
SCHEMBL4491870 0.77 EGLN1 (0.35) ABL1BCREGLN1
SCHEMBL4463288 0.77 RXRA (0.37) ABL1BCREGLN1HPGDSALKBH2
SCHEMBL4479194 0.77 RXRA (0.37) ABL1BCREGLN1HPGDSALKBH2
SCHEMBL4478485 0.76 ABL1 (0.37) BRAFABL1BCREGLN1
SCHEMBL4486668 0.75 XDH (0.40) EGLN1
SCHEMBL4466806 0.73 BRAF (0.41) BRAF
SCHEMBL4484455 0.72 ABL1 (0.42) BRAFABL1BCREGLN1
SCHEMBL4478699 0.72 EGLN1 (0.44) BRAFABL1BCREGLN1

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
US-7485657-B2 Anti-cytokine heterocyclic compounds BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2009-02-03 US claimed
US-20050256113-A1 Anti-cytokine heterocyclic compounds BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-11-17 US claimed
US-7485657-B2 Anti-cytokine heterocyclic compounds BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2009-02-03 US disclosed
EP-1756065-A1 ANTI-CYTOKINE HETEROCYCLIC COMPOUNDS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2007-02-28 EP disclosed
WO-2005115991-A1 ANTI-CYTOKINE HETEROCYCLIC COMPOUNDS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-12-08 WO disclosed
US-20050256113-A1 Anti-cytokine heterocyclic compounds BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-11-17 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-20050256113-A1 Anti-cytokine heterocyclic compounds TNF, IL6, IL2 BRAF 4079/4885ABL1 1997/4885BCR 1202/4885

“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.