SCHEMBL6434049

SCHEMBL6434049

COc1ccccc1NC(=O)[C@H]1C[C@@H]1c1ccc(-c2nn(C3CCC(=O)CC3)c3ncnc(N)c23)cc1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.64
BTK Q06187 9/20 0.64
LCK P06239 3/20 0.55
SRC P12931 3/20 0.55
TEK Q02763 3/20 0.55
KDR P35968 1/20 0.52

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
SCHEMBL6434045 0.93 SRC (0.61) EGFRBTKLCKSRCTEK
SCHEMBL6431419 0.93 SRC (0.61) EGFRBTKLCKSRCTEK
SCHEMBL6430409 0.90 EGFR (0.57) EGFRBTKLCKSRCTEK
SCHEMBL4827919 0.84 LCK (0.69) LCKSRCTEKKDR
SCHEMBL4827920 0.84 LCK (0.69) LCKSRCTEKKDR
SCHEMBL4823873 0.84 LCK (0.63) EGFRLCKSRCTEKKDR
SCHEMBL6434104 0.84 LCK (0.63) EGFRLCKSRCTEKKDR
SCHEMBL6430405 0.82 LCK (0.59) EGFRLCKSRCTEKKDR
SCHEMBL4827216 0.82 LCK (0.59) EGFRLCKSRCTEKKDR
SCHEMBL4827213 0.82 LCK (0.59) EGFRLCKSRCTEKKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6921763-B2 Pyrazolopyrimidines as therapeutic agents ABBOTT LABORATORIES (US) 2005-07-26 US disclosed
US-6660744-B1 Kinase inhibitors ABBOTT GMBH & CO. KG (DE) 2003-12-09 US disclosed
EP-1212327-B1 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS BASF AG (DE) 2003-08-20 EP disclosed
US-20020156081-A1 Pyrazolopyrimidines as therapeutic agents ABBOTT LABORATORIES (US) 2002-10-24 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-20020156081-A1 Pyrazolopyrimidines as therapeutic agents DPYD, CYP2D6, UGT1A1 EGFR 2229/4885BTK 1020/4885LCK 1011/4885

“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.