SCHEMBL11486236

SCHEMBL11486236

CCOC(=O)c1c(O)c2ccc(C)nc2n(CC)c1=O.[NaH]

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.59
ALDH1A1 P00352 7/20 0.55
LMNA P02545 3/20 0.49
HTT P42858 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
USP2 O75604 1/20 0.46
HSD17B10 Q99714 1/20 0.46
RECQL P46063 1/20 0.46
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 1/20 0.44
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.43
ADORA1 P30542 1/20 0.42
KDM5A P29375 1/20 0.40
KDM5B Q9UGL1 1/20 0.40

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
SCHEMBL11083105 0.99 KDM4E (0.60) KDM4EALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL11486123 0.89 ALDH1A1 (0.57) KDM4EALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL11639605 0.86 KDM4E (0.49) KDM4EALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL7832109 0.86 KDM4E (0.58) KDM4EALDH1A1LMNAHTTMEN1
SCHEMBL3522404 0.86 LMNA (0.64) KDM4EALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL11637475 0.86 KDM4E (0.49) KDM4EALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL8141322 0.86 ALDH1A1 (0.61) KDM4EALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL11167153 0.85 KDM4E (0.47) KDM4EALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL11083016 0.85 L3MBTL1 (0.50) KDM4EALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL2084677 0.85 KDM4E (0.51) KDM4EALDH1A1LMNAHTTSMN1; SMN2

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
US-4215123-A Antisecretory 4-oxy-3-carboxy or cyano-1,2-dihydro-2-oxo-1,8-naphthyridine derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1980-07-29 US claimed
US-4215123-A Antisecretory 4-oxy-3-carboxy or cyano-1,2-dihydro-2-oxo-1,8-naphthyridine derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1980-07-29 US disclosed