SCHEMBL4478485

SCHEMBL4478485

CON(C(=O)c1ccc(C)c(-n2cc(C(=O)O)cn2)c1)c1cc(NC(C)=O)cc(C(C)(C)C)c1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 7/20 0.37
BCR P11274 7/20 0.37
NR1I2 O75469 1/20 0.34
BRAF P15056 2/20 0.34
EGLN1 Q9GZT9 5/20 0.33
P2RY14 Q15391 1/20 0.33
ALKBH1 Q13686 2/20 0.33

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
SCHEMBL4491870 0.86 EGLN1 (0.35) ABL1BCREGLN1ALKBH1
SCHEMBL4486668 0.84 XDH (0.40) EGLN1ALKBH1
SCHEMBL4469729 0.83 NR2E1 (0.35) ABL1BCRNR1I2
SCHEMBL4478699 0.78 EGLN1 (0.44) ABL1BCRBRAFEGLN1ALKBH1
SCHEMBL4484461 0.76 BRAF (0.40) ABL1BCRBRAFEGLN1
SCHEMBL4478482 0.76 ABL1 (0.41) ABL1BCRBRAFEGLN1
SCHEMBL4478022 0.73 RXRA (0.37) NR1I2BRAF
Pivalamide SCHEMBL5179479 0.73 ABL1 (0.39) ABL1BCRBRAF
SCHEMBL4466806 0.72 BRAF (0.41) BRAF
SCHEMBL5199007 0.72 RXRB (0.32) NR1I2

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 3 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-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 ABL1 1997/4885BCR 1202/4885NR1I2 734/4885

“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.