SCHEMBL22172012

SCHEMBL22172012

O=C(c1cccc(-c2ccccc2)c1)c1ccccn1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.71
▸ HSD17B14 Q9BPX1 1/20 0.55
▸ KMO O15229 3/20 0.53
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ LMNA P02545 2/20 0.52
▸ NAPRT Q6XQN6 1/20 0.52
▸ P4HTM Q9NXG6 1/20 0.52
▸ KCNK3 O14649 1/20 0.51
▸ KCNK9 Q9NPC2 1/20 0.51
▸ HDAC1 Q13547 1/20 0.51
▸ SLC6A7 Q99884 1/20 0.49
▸ HDAC8 Q9BY41 1/20 0.49
▸ CES2 O00748 1/20 0.48
▸ CES1 P23141 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.46
▸ ATM Q13315 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ NPC1 O15118 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ PKM P14618 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
SCHEMBL7536679 0.88 KMT2A (0.58) KMT2AHSD17B14KMOKCNK3KCNK9
SCHEMBL23572370 0.85 KMT2A (0.73) KMT2AHSD17B14L3MBTL1LMNANAPRT
SCHEMBL29373829 0.84 KMT2A (1.00) KMT2AHSD17B14L3MBTL1LMNANAPRT
SCHEMBL398165 0.84 KMT2A (1.00) KMT2AHSD17B14L3MBTL1LMNANAPRT
SCHEMBL28015961 0.82 KMT2A (0.96) KMT2AHSD17B14L3MBTL1LMNANAPRT
SCHEMBL28005707 0.82 KMT2A (0.96) KMT2AHSD17B14L3MBTL1LMNANAPRT
SCHEMBL3836551 0.80 KMT2A (0.66) KMT2AHSD17B14KCNK3KCNK9CES2
SCHEMBL8586217 0.80 KMT2A (0.66) KMT2AHSD17B14L3MBTL1LMNANAPRT
SCHEMBL30659509 0.80 KMT2A (0.66) KMT2AHSD17B14L3MBTL1LMNANAPRT
SCHEMBL12441772 0.80 KMT2A (0.66) KMT2AHSD17B14LMNAKCNK3KCNK9

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-2020135686-A1 ORGANIC COMPOUND WITH CARBAZOLE DERIVATIVE AS CORE AND APPLICATION THEREOF TO ORGANIC ELECTROLUMINESCENT DEVICE 江苏三月光电科技有限公司 2020-07-02 — — WO disclosed
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