SCHEMBL19089291

SCHEMBL19089291

COc1cc(N(C)CCN(C)C)c(N)cc1Nc1nccc(Nc2ccc(OCc3ccccn3)c(Cl)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 19/20 0.47
ERBB2 P04626 4/20 0.47
IGF1R P08069 1/20 0.46
ALK Q9UM73 3/20 0.45
EML4 Q9HC35 2/20 0.44
ERBB3 P21860 1/20 0.42
ERBB4 Q15303 1/20 0.42

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
SCHEMBL20655389 0.91 EGFR (0.45) EGFRERBB2IGF1R
SCHEMBL19089532 0.88 EGFR (0.46) EGFRERBB2IGF1RALKEML4
SCHEMBL19089297 0.87 EGFR (0.53) EGFRERBB2ERBB4
SCHEMBL19089290 0.85 EGFR (0.66) EGFRALKEML4
SCHEMBL19089365 0.80 EGFR (0.49) EGFRIGF1RALKEML4
SCHEMBL17385155 0.79 EGFR (0.71) EGFRERBB2ALKEML4ERBB3
SCHEMBL19089372 0.79 EGFR (0.62) EGFRERBB2ALKEML4
SCHEMBL20655613 0.78 EGFR (0.58) EGFRERBB2ALKEML4
SCHEMBL19089585 0.78 EGFR (0.56) EGFRERBB2
SCHEMBL19089597 0.78 EGFR (0.63) EGFRERBB2IGF1RALKEML4

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-10342796-B2 Acrylanilide derivative, preparation method, and applications thereof in pharmacy ANCUREALL PHARMACEUTICAL (SHANGHAI) CO., LTD. (CN) 2019-07-09 US disclosed
US-20190015413-A1 ACRYLANILIDE DERIVATIVE, PREPARATION METHOD, AND APPLICATIONS THEREOF IN PHARMACY ANCUREALL PHARMACEUTICAL (SHANGHAI) CO., LTD. (CN) 2019-01-17 US disclosed
WO-2017114500-A1 ACRYLANILIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF IN PHARMACY 恩瑞生物医药科技(上海)有限公司 2017-07-06 WO 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 (2 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-10342796-B2 Acrylanilide derivative, preparation method, and applications thereof in pharmacy EGFR, ABL1, CSNK1A1 EGFR 1/4885ERBB2 4/4885IGF1R 619/4885
US-20190015413-A1 ACRYLANILIDE DERIVATIVE, PREPARATION METHOD, AND APPLICATIONS THEREOF IN PHARMACY EGFR, ABL1, CSNK1A1 EGFR 1/4885ERBB2 4/4885IGF1R 619/4885

“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.