SCHEMBL19027406

SCHEMBL19027406

C=CC(=O)Nc1cc(Nc2ncc(C)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC)cc1N1CCC(N2CCN(C)CC2)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 20/20 0.73
▸ EGFR P00533 7/20 0.73
▸ INSR P06213 9/20 0.63
▸ EML4 Q9HC35 5/20 0.63
▸ IGF1R P08069 5/20 0.63
▸ ROS1 P08922 3/20 0.63
▸ FER P16591 3/20 0.63
▸ LTK P29376 3/20 0.63
▸ PTK2 Q05397 3/20 0.63
▸ BTK Q06187 3/20 0.63
▸ TNK2 Q07912 3/20 0.63
▸ SLK Q9H2G2 3/20 0.63
▸ BMPR1B O00238 2/20 0.63
▸ PLK4 O00444 2/20 0.63
▸ GAK O14976 2/20 0.63
▸ ERN1 O75460 2/20 0.63
▸ STK10 O94804 2/20 0.63
▸ ABL1 P00519 2/20 0.63
▸ LCK P06239 2/20 0.63
▸ FYN P06241 2/20 0.63

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
SCHEMBL19027412 0.93 ALK (0.85) ALKEGFRINSREML4IGF1R
SCHEMBL19027868 0.91 ALK (0.63) ALKEGFRINSREML4IGF1R
SCHEMBL19027408 0.89 ALK (0.58) ALKEGFRINSREML4IGF1R
SCHEMBL22520226 0.88 EGFR (0.58) ALKEGFRINSRIGF1RKCNH2
SCHEMBL21364015 0.87 ALK (0.65) ALKEGFRINSREML4IGF1R
SCHEMBL19027555 0.87 ALK (0.71) ALKEGFRINSREML4ROS1
SCHEMBL19027794 0.87 ALK (0.95) ALKEGFRINSREML4IGF1R
SCHEMBL22497639 0.86 ALK (0.71) ALKEGFRINSREML4IGF1R
SCHEMBL19027796 0.86 ALK (0.81) ALKEGFRINSREML4IGF1R
SCHEMBL21363944 0.85 EGFR (0.78) ALKEGFRINSREML4IGF1R

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.

Send feedback