SCHEMBL7847715

SCHEMBL7847715

Cc1cccnc1-c1cccc2c(C(=O)O)cccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.54
TDP1 Q9NUW8 1/20 0.54
MYC P01106 2/20 0.49
L3MBTL1 Q9Y468 3/20 0.45
KDM6B O15054 1/20 0.45
KDM6A O15550 1/20 0.45
TET3 O43151 1/20 0.45
KDM4A O75164 1/20 0.45
KDM4B O94953 1/20 0.45
KDM5C P41229 1/20 0.45
KDM4D Q6B0I6 1/20 0.45
TET2 Q6N021 1/20 0.45
ALKBH5 Q6P6C2 1/20 0.45
TET1 Q8NFU7 1/20 0.45
FTO Q9C0B1 1/20 0.45
EGLN1 Q9GZT9 1/20 0.45
KDM4C Q9H3R0 1/20 0.45
KDM2A Q9Y2K7 1/20 0.45
KDM3A Q9Y4C1 1/20 0.45
ALDH1A1 P00352 2/20 0.45

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
SCHEMBL6876755 0.86 KDM4E (0.59) KDM4ETDP1MYCL3MBTL1KDM4C
SCHEMBL30555267 0.86 KDM4E (0.59) KDM4ETDP1MYCL3MBTL1KDM4C
SCHEMBL31190966 0.84 KDM4E (0.53) KDM4ETDP1MYCL3MBTL1ALDH1A1
SCHEMBL8111830 0.81 DHODH (0.53) KDM4ETDP1MYCL3MBTL1KDM6B
SCHEMBL15903248 0.81 KDM4E (0.50) KDM4ETDP1MYCL3MBTL1ALDH1A1
SCHEMBL725345 0.81 KDM4E (0.50) KDM4ETDP1MYCL3MBTL1ALDH1A1
SCHEMBL7032479 0.80 KDM4E (0.78) KDM4ETDP1MYCL3MBTL1ALDH1A1
SCHEMBL10000544 0.80 KDM4E (0.65) KDM4ETDP1MYCL3MBTL1KDM4C
SCHEMBL8102349 0.77 KDM4E (0.50) KDM4ETDP1L3MBTL1KDM6BKDM6A
SCHEMBL14936823 0.77 KDM4E (0.61) KDM4ETDP1L3MBTL1ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1335850-A Quinoline derivatives SMITHKLINE BEECHMA PLC (GB) 2002-02-13 CN disclosed
EP-1140946-A2 QUINOLINE DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 2001-10-10 EP disclosed
WO-2000035919-A2 QUINOLINE DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 2000-06-22 WO disclosed