SCHEMBL3514951

SCHEMBL3514951

Cc1cc(Nc2cc(NC(=O)c3c(Cl)cc(CO)cc3Cl)ccn2)nc(NCCCO)n1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.60
TYK2 P29597 19/20 0.53
JAK2 O60674 13/20 0.46
JAK1 P23458 9/20 0.46

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
SCHEMBL3514634 0.95 EGFR (0.62) EGFRTYK2JAK2JAK1
SCHEMBL3514113 0.93 EGFR (0.58) EGFRTYK2JAK2JAK1
SCHEMBL3517250 0.93 EGFR (0.62) EGFRTYK2JAK2JAK1
SCHEMBL3514225 0.91 EGFR (0.72) EGFRTYK2JAK2JAK1
SCHEMBL3514100 0.91 EGFR (0.56) EGFRTYK2JAK2JAK1
SCHEMBL3516225 0.89 EGFR (0.57) EGFRTYK2JAK2JAK1
SCHEMBL3514089 0.88 EGFR (0.53) EGFRTYK2JAK2JAK1
SCHEMBL3512965 0.88 EGFR (0.60) EGFRTYK2JAK2JAK1
SCHEMBL3513996 0.87 EGFR (0.64) EGFRTYK2JAK2JAK1
SCHEMBL3513788 0.85 EGFR (0.74) EGFRTYK2JAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100317643-A1 JANUS KINASE INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2010-12-16 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-20100317643-A1 JANUS KINASE INHIBITOR COMPOUNDS AND METHODS JAK2, JAK1, JAK3 EGFR 212/4885TYK2 21/4885JAK2 1/4885

“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.