SCHEMBL29395233

SCHEMBL29395233

CS(=O)(=O)c1ccc(-c2cc(N3CCOCC3)nc3c(-c4ccn[nH]4)nccc23)c(F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 20/20 1.00
▸ ATRIP Q8WXE1 20/20 1.00
▸ KCNH2 Q12809 1/20 0.79

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
SCHEMBL29395225 1.00 ATR (1.00) ATRATRIPKCNH2
SCHEMBL17501153 1.00 ATR (1.00) ATRATRIPKCNH2
SCHEMBL20483283 0.91 ATR (0.83) ATRATRIPKCNH2
SCHEMBL20081844 0.88 ATR (1.00) ATRATRIP
SCHEMBL29395599 0.88 ATR (1.00) ATRATRIP
SCHEMBL17501136 0.88 ATR (1.00) ATRATRIP
SCHEMBL30140475 0.87 ATR (1.00) ATRATRIP
SCHEMBL17527614 0.87 ATR (1.00) ATRATRIP
SCHEMBL17501548 0.86 ATR (1.00) ATRATRIPKCNH2
SCHEMBL23837708 0.85 ATR (0.77) ATRATRIP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110204544-B 2- (morpholin-4-yl) -1, 7-naphthyridine 拜耳制药股份公司 2022-04-12 — — CN disclosed
CN-110256427-B 2- (morpholin-4-yl) -1, 7-naphthyridine 拜耳制药股份公司 2022-02-22 — — CN disclosed
Send feedback