SCHEMBL11549547

SCHEMBL11549547

Cc1ccc(-c2cn(C)cc(-c3ccccc3)c2=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 3/20 0.44
▸ HPRT1 P00492 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ LMNA P02545 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ CREBBP Q92793 1/20 0.39
▸ SLC2A1 P11166 1/20 0.39
▸ ALDH1A3 P47895 1/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39
▸ RELA Q04206 1/20 0.39
▸ CA12 O43570 1/20 0.38

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
SCHEMBL11550515 0.92 BRD4 (0.41) BRD4SMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL11547644 0.90 BRD4 (0.48) BRD4L3MBTL1LMNAMAPTHTT
SCHEMBL11441314 0.90 BRD4 (0.52) BRD4LMNAMAPTHTTSMN1; SMN2
SCHEMBL11437271 0.86 MAOB (0.43) BRD4L3MBTL1MAPTALDH1A1HPGD
SCHEMBL11551075 0.86 BRD4 (0.45) BRD4L3MBTL1LMNAMAPTSMN1; SMN2
SCHEMBL11426297 0.86 BRD9 (0.53) BRD4MAPTALDH1A1CREBBPMAOB
SCHEMBL11434522 0.84 CNR2 (0.43) BRD4L3MBTL1LMNAMAPTSMN1; SMN2
SCHEMBL11428354 0.84 BRD4 (0.41) BRD4MAPTCREBBPMAOBKDM4E
SCHEMBL11555425 0.84 BRD4 (0.41) BRD4L3MBTL1LMNAMAPTCREBBP
SCHEMBL11551182 0.84 CYP1A2 (0.48) BRD4LMNAMAPTHTTSMN1; SMN2

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-4152136-A HERBICIDES ELI LILLY AND COMPANY (US) 1979-05-01 — — US disclosed
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