SCHEMBL17196703

SCHEMBL17196703

C=CC(=O)Nc1cc(Nc2cc(OC3CN(C(=O)c4ccccc4)C3)ccn2)c(OC)cc1N1CCC(N(C)C)CC1

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.60

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
SCHEMBL17196882 0.87 EGFR (0.67) EGFR
SCHEMBL17196695 0.81 EGFR (0.64) EGFR
SCHEMBL17196702 0.81 EGFR (0.64) EGFR
SCHEMBL17196674 0.78 EGFR (0.69) EGFR
SCHEMBL18657498 0.77 EGFR (0.70) EGFR
SCHEMBL18657386 0.77 EGFR (0.66) EGFR
SCHEMBL17196704 0.76 EGFR (0.65) EGFR
SCHEMBL19089321 0.76 EGFR (0.62) EGFR
SCHEMBL17196681 0.75 EGFR (0.66) EGFR
SCHEMBL17196807 0.74 EGFR (0.58) EGFR

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
EP-3144292-B1 2,3,4,6-TETRA-SUBSTITUTED BENZENE-1,5-DIAMINE DERIVATIVES, PREPARATION METHOD THEREFOR AND MEDICINAL USE THEREOF SHANGHAI HAIYAN PHARMACEUTICAL TECH CO LTD (US) 2020-08-26 EP disclosed
EP-3144292-A1 2,3,4,6-TETRA-SUBSTITUTED BENZENE-1,5-DIAMINE DERIVATIVES, PREPARATION METHOD THEREFOR AND MEDICINAL USE THEREOF SHANGHAI HAIYAN PHARMACEUTICAL TECHNOLOGY CO., LTD (US) 2017-03-22 EP disclosed
WO-2015158233-A1 2,3,4,6-TETRA-SUBSTITUTED BENZENE-1,5-DIAMINE DERIVATIVES, PREPARATION METHOD THEREFOR AND MEDICINAL USE THEREOF 上海海雁医药科技有限公司 2015-10-22 WO disclosed