SCHEMBL19027407

SCHEMBL19027407

C=CC(=O)Nc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC)cc1N1CCN[C@H](C)C1

nearest known ligand 0.76

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 20/20 0.76
▸ EGFR P00533 4/20 0.76
▸ INSR P06213 5/20 0.64
▸ ROS1 P08922 2/20 0.64
▸ ERBB2 P04626 1/20 0.64
▸ FER P16591 1/20 0.64
▸ LTK P29376 1/20 0.64
▸ BLK P51451 1/20 0.64
▸ PTK2 Q05397 1/20 0.64
▸ BTK Q06187 1/20 0.64
▸ TNK2 Q07912 1/20 0.64
▸ ERBB4 Q15303 1/20 0.64
▸ SLK Q9H2G2 1/20 0.64
▸ EML4 Q9HC35 1/20 0.64

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
SCHEMBL20537119 1.00 ALK (0.76) ALKEGFRINSRROS1ERBB2
SCHEMBL19027414 1.00 ALK (0.76) ALKEGFRINSRROS1ERBB2
SCHEMBL19027548 0.92 ALK (0.65) ALKEGFRINSRROS1ERBB2
SCHEMBL19027381 0.92 ALK (0.82) ALKEGFRINSRROS1ERBB2
SCHEMBL19027405 0.89 ALK (0.89) ALKEGFRINSRROS1ERBB2
SCHEMBL19027794 0.89 ALK (0.95) ALKEGFRINSRROS1ERBB2
SCHEMBL19027384 0.88 ALK (0.82) ALKEGFRINSRROS1ERBB2
SCHEMBL19027947 0.88 ALK (0.84) ALKEGFRINSRROS1ERBB2
SCHEMBL16781018 0.88 EGFR (0.75) ALKEGFRINSRROS1ERBB2
SCHEMBL20537120 0.88 ALK (0.83) ALKEGFRINSRROS1ERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10350210-B2 EGFR and ALK dual inhibitor PRECEDO PHARMACEUTICALS CO., LTD (CN) 2019-07-16 — — US disclosed
US-10350210-B2 EGFR and ALK dual inhibitor PRECEDO PHARMACEUTICALS CO., LTD (CN) 2019-07-16 — — US disclosed
US-20180369242-A1 NOVEL EGFR AND ALK DUAL INHIBITOR PRECEDO PHARMACEUTICALS CO., LTD (CN) 2018-12-27 — — US disclosed
EP-3392245-A1 NOVEL EGFR AND ALK DUAL INHIBITOR Precedo Pharmaceuticals Co., Ltd. (CN) 2018-10-24 — — EP disclosed
WO-2017101803-A1 NOVEL EGFR AND ALK DUAL INHIBITOR 合肥中科普瑞昇生物医药科技有限公司 2017-06-22 — — 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-20180369242-A1 NOVEL EGFR AND ALK DUAL INHIBITOR ALK, EGFR, NPM1 ALK 1/4885EGFR 2/4885INSR 909/4885
US-10350210-B2 EGFR and ALK dual inhibitor ALK, EGFR, ERBB2 ALK 1/4885EGFR 2/4885INSR 969/4885

“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.

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