SCHEMBL28149402

SCHEMBL28149402

CC(C)(O)C(C)(C)Oc1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 2/20 0.45
▸ PTGS2 P35354 4/20 0.42
▸ PTGS1 P23219 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ ELANE P08246 1/20 0.40
▸ HSD11B1 P28845 1/20 0.37
▸ PPARA Q07869 1/20 0.37
▸ AKR1C3 P42330 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 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
SCHEMBL13551948 0.80 ENPP2 (0.46) ENPP2PTGS2PTGS1SMN1; SMN2ELANE
Boric Acid SCHEMBL28014845 0.80 ALDH1A1 (0.47) PTGS2PTGS1ALDH1A1
SCHEMBL9195881 0.76 PTGS2 (0.41) ENPP2PTGS2PTGS1SMN1; SMN2ELANE
SCHEMBL7991386 0.76 PPARA (0.61) ENPP2PPARAALDH1A1LMNA
Boric Acid SCHEMBL27989719 0.75 ENPP2 (0.40) ENPP2PTGS2PTGS1SMN1; SMN2ALDH1A1
SCHEMBL514383 0.75 PTGS2 (0.65) ENPP2PTGS2PTGS1SMN1; SMN2
SCHEMBL9036922 0.74 PTGS2 (0.42) ENPP2PTGS2PTGS1SMN1; SMN2ELANE
SCHEMBL27920698 0.74 CA1 (0.50) ENPP2ELANEALDH1A1
SCHEMBL17501064 0.73 ENPP2 (0.53) ENPP2PTGS2SMN1; SMN2
SCHEMBL17312043 0.72 CA1 (0.48) ENPP2ELANEALDH1A1

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-110256427-A 2- (morpholin-4-yl) -1, 7-naphthyridine 拜耳制药股份公司 2019-09-20 — — CN disclosed
CN-110204544-A 2- (morpholin-4-yl) -1, 7-naphthyridine 拜耳制药股份公司 2019-09-06 — — CN disclosed
CN-106795156-B 2- (morpholin-4-yl) -1, 7-naphthyridine 拜耳制药股份公司 2019-07-30 — — CN disclosed
CN-106795156-A 2- (morpholin-4-yl) -1, 7-naphthyridine 拜耳制药股份公司 2017-05-31 — — CN disclosed
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