SCHEMBL17675304

SCHEMBL17675304

Cc1ccnc(NC(=O)c2ccc(O)cc2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ SORT1 Q99523 1/20 0.51
▸ KMT2A Q03164 5/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ GAA P10253 2/20 0.49
▸ POLB P06746 2/20 0.49
▸ GRM5 P41594 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ MAPT P10636 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ TP53 P04637 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ KCNH2 Q12809 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ NPC1 O15118 1/20 0.46

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
SCHEMBL17675284 0.80 RAB9A (0.55) KMT2AMEN1CYP3A4ALDH1A1NPC1
SCHEMBL15881328 0.78 L3MBTL1 (0.55) L3MBTL1SORT1KMT2AMEN1GAA
SCHEMBL23015840 0.78 TDP1 (0.56) L3MBTL1KMT2AMEN1POLBGRM5
SCHEMBL17675324 0.78 SYK (0.50) SORT1GAA
SCHEMBL14631434 0.77 CA1 (0.53) L3MBTL1SORT1KMT2AMEN1GAA
SCHEMBL14298343 0.76 L3MBTL1 (0.54) L3MBTL1SORT1KMT2AMEN1GAA
SCHEMBL16321370 0.76 ALOX15 (0.51) L3MBTL1SORT1KMT2AMEN1POLB
SCHEMBL28200980 0.74 LMNA (0.53) L3MBTL1KMT2AMEN1POLBCYP3A4
SCHEMBL29141778 0.73 NPC1 (0.55) L3MBTL1SORT1KMT2AMEN1GAA
SCHEMBL28580981 0.73 MPO (0.50) L3MBTL1KMT2AMEN1GAAPOLB

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
WO-2016055982-A1 QUINOLINE AND QUINAZOLINE COMPOUNDS ACERTA PHARMA B.V. (NL) 2016-04-14 — — WO disclosed
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