SCHEMBL29398049

SCHEMBL29398049

C[C@@H]1COCCN1c1cc(-c2cccc(S(C)(=O)=O)c2F)c2ccnc(-c3ccnn3C3CCCCO3)c2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 20/20 1.00

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
SCHEMBL17501188 1.00 ATR (1.00) ATR
SCHEMBL29397624 0.91 ATR (1.00) ATR
SCHEMBL17501325 0.91 ATR (1.00) ATR
SCHEMBL20082019 0.91 ATR (1.00) ATR
SCHEMBL17527612 0.90 ATR (0.88) ATR
SCHEMBL20081782 0.89 ATR (0.85) ATR
SCHEMBL20081766 0.89 ATR (1.00) ATR
SCHEMBL17501099 0.89 ATR (1.00) ATR
SCHEMBL29397614 0.89 ATR (1.00) ATR
SCHEMBL17501293 0.88 ATR (1.00) ATR

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