SCHEMBL30148832

SCHEMBL30148832

c1ncc2nnncc2n1

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.37

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
Pyrrole SCHEMBL81014 0.87 EGFR (0.33) EGFR
SCHEMBL127479 0.79 EGFR (0.50) EGFR
SCHEMBL28003243 0.76 EGFR (0.48) EGFR
SCHEMBL29464263 0.74 PIK3CG (0.38) EGFR
SCHEMBL29946334 0.67
SCHEMBL11882020 0.66 EGFR (0.37) EGFR
SCHEMBL29389802 0.65 ALDH1A1 (0.44)
SCHEMBL162279 0.65 ALDH1A1 (0.44)
SCHEMBL30826363 0.65 EGFR (0.35) EGFR
SCHEMBL29865299 0.65 EGFR (0.50) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115594669-A Fused ring derivative and preparation method and medical application thereof 深圳信立泰药业股份有限公司(CN) 2023-01-13 CN claimed
CN-115461334-A Benzimidazole derivative and preparation method and medical application thereof 深圳信立泰药业股份有限公司 2022-12-09 CN claimed
CN-115515956-A Benzimidazole derivative and preparation method and medical application thereof 深圳信立泰药业股份有限公司 2022-12-23 CN disclosed
CN-115461334-A Benzimidazole derivative and preparation method and medical application thereof 深圳信立泰药业股份有限公司 2022-12-09 CN disclosed