SCHEMBL11396609

SCHEMBL11396609

Cc1cc(-c2ccc(-c3ccc(F)cc3)cc2)nn(C)c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.47
▸ RAD51 Q06609 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ KDM4C Q9H3R0 1/20 0.43
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HDAC3 O15379 2/20 0.41
▸ HDAC4 P56524 2/20 0.41
▸ HDAC1 Q13547 2/20 0.41
▸ HDAC2 Q92769 2/20 0.41
▸ HDAC8 Q9BY41 2/20 0.41
▸ HDAC6 Q9UBN7 2/20 0.41
▸ HDAC7 Q8WUI4 1/20 0.41
▸ HDAC10 Q969S8 1/20 0.41
▸ HDAC11 Q96DB2 1/20 0.41
▸ HDAC9 Q9UKV0 1/20 0.41

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
SCHEMBL22130216 0.82 BRD4 (0.48) BRD4MAPTMEN1KMT2ANPC1
SCHEMBL11254410 0.80 BRD4 (0.49) BRD4MAPTKDM4CKDM5B
SCHEMBL1375300 0.79 NPC1 (0.48) BRD4MAPTKDM4CMEN1KMT2A
SCHEMBL22130283 0.79 BRD4 (0.48) BRD4MAPT
SCHEMBL11391433 0.78 HRH3 (0.52) MEN1KMT2ASCN4A
SCHEMBL16202036 0.78 ALDH1A1 (0.52) RAD51MAPTMEN1KMT2ANPC1
SCHEMBL22130176 0.76 BRD4 (0.46) BRD4MAPTKMT2A
SCHEMBL11395461 0.75 SMN1; SMN2 (0.43) BRD4MAPTKMT2ANPC1RAB9A
SCHEMBL11394742 0.74 BRD4 (0.44) BRD4RAD51MAPTKDM4CNPC1
SCHEMBL10112053 0.74 SMN1; SMN2 (0.59) MAPTMEN1KMT2ANPC1RAB9A

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
US-4289774-A Lipid lowering and anti-thrombotic 6-arylpyridazin-3-ones and a process for their preparation MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1981-09-15 — — US disclosed
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