SCHEMBL5856934

SCHEMBL5856934

CN(C)CCC(=O)N(C)c1ccc(N/C(=C2\C(=O)Nc3cc(Br)ccc32)c2ccc3c(c2)OOC3)cc1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.34
TERT O14746 3/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30

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
SCHEMBL5856885 0.92 BACE1 (0.34)
SCHEMBL5859772 0.90 NAMPT (0.31)
SCHEMBL5858302 0.90 RXFP1 (0.36)
SCHEMBL5858204 0.89 POLB (0.33) EGFR
SCHEMBL3935847 0.88 AAK1 (0.41) HDAC1HDAC2
SCHEMBL5856943 0.87 RAB9A (0.43) EGFR
SCHEMBL3935816 0.87 RAB9A (0.43) EGFR
SCHEMBL5858412 0.86 MITF (0.31)
SCHEMBL3931880 0.84 BACE1 (0.33) HDAC1HDAC2
SCHEMBL4491116 0.84 EGFR (0.40) EGFRTERT

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-7148249-B2 Indolinones substituted by heterocycles, the preparation thereof and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-12-12 US disclosed
US-20050054710-A1 Indolinones substituted by heterocycles, the preparation thereof and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-03-10 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-20050054710-A1 Indolinones substituted by heterocycles, the preparation thereof and their use as medicaments CDK1, CDK2, CDK3 EGFR 107/4885TERT 1848/4885HDAC1 788/4885

“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.