SCHEMBL13570508

SCHEMBL13570508

CC1CCN(Cc2ccc3cccnc3c2O)c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 1/20 0.51
▸ KDM4E B2RXH2 7/20 0.42
▸ TP53 P04637 6/20 0.42
▸ L3MBTL1 Q9Y468 6/20 0.42
▸ ALOX12 P18054 6/20 0.42
▸ HTT P42858 5/20 0.42
▸ LMNA P02545 5/20 0.42
▸ KMT2A Q03164 5/20 0.42
▸ MAPT P10636 5/20 0.42
▸ ALDH1A1 P00352 5/20 0.42
▸ USP2 O75604 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ NPSR1 Q6W5P4 4/20 0.39
▸ ALOX15 P16050 4/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ HSP90AA1 P07900 3/20 0.39
▸ CYP1A2 P05177 2/20 0.39

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
SCHEMBL2357967 0.80 L3MBTL1 (0.39) BCHEKDM4ETP53L3MBTL1ALOX12
SCHEMBL2143801 0.75 ALDH1A1 (0.47) BCHEALDH1A1EGLN1
SCHEMBL2237500 0.73 BCHE (0.67) BCHEKDM4ETP53L3MBTL1ALOX12
SCHEMBL26241625 0.73 BCHE (0.74) BCHEKDM4ETP53L3MBTL1ALOX12
Hydrochloric Acid SCHEMBL19437125 0.72 BCHE (0.66) BCHEKDM4ETP53L3MBTL1ALOX12
SCHEMBL1787096 0.72 KDM4E (0.68) BCHEKDM4ETP53L3MBTL1ALOX12
SCHEMBL26241636 0.70 BCHE (0.70) BCHEKDM4ETP53L3MBTL1ALOX12
SCHEMBL9976030 0.69 BCHE (0.69) BCHEKDM4ETP53L3MBTL1ALOX12
SCHEMBL14213275 0.69 KDM4E (0.59) BCHEKDM4ETP53L3MBTL1ALOX12
SCHEMBL2143758 0.69 BCHE (0.49) BCHEKDM4ETP53L3MBTL1ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2519505-A1 NEW TERTIARY 8-HYDROXYQUINOLINE-7-CARBOXAMIDE DERIVATIVES AND USES THEREOF Polichem SA (LU) 2012-11-07 — — EP claimed
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