SCHEMBL11428173

SCHEMBL11428173

Cc1ccc(-c2cn(C)cc(-c3ccccc3)c2=O)cc1Br

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.40
▸ CREBBP Q92793 2/20 0.36
▸ MAOB P27338 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.35
▸ ALDH1A1 P00352 4/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ALKBH5 Q6P6C2 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ ADORA1 P30542 1/20 0.33
▸ ESR2 Q92731 1/20 0.33

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
SCHEMBL11428912 0.86 BRD4 (0.46) BRD4CREBBPHSD17B10ALDH1A1MAPK1
SCHEMBL11439976 0.83 KCNA3 (0.39) HSD17B10ALDH1A1MEN1KMT2AKDM4E
SCHEMBL11554573 0.81 ALDH1A1 (0.48) BRD4CREBBPHSD17B10ALDH1A1MAPK1
SCHEMBL11547644 0.81 BRD4 (0.48) BRD4CREBBPHSD17B10ALDH1A1LMNA
SCHEMBL11441314 0.80 BRD4 (0.52) BRD4CREBBPHSD17B10ALDH1A1LMNA
SCHEMBL11178194 0.80 BRD4 (0.40) BRD4MAOBHSD17B10ALDH1A1MEN1
SCHEMBL11549258 0.79 BRD4 (0.44) BRD4CREBBPMAOBHSD17B10ALDH1A1
SCHEMBL11549547 0.79 BRD4 (0.44) BRD4CREBBPMAOBHSD17B10ALDH1A1
SCHEMBL11434522 0.78 CNR2 (0.43) BRD4CREBBPMAOBALDH1A1LMNA
SCHEMBL11441378 0.78 BRD4 (0.43) BRD4CREBBPHSD17B10ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4235619-A USING 3-PHENYL-4(1H)-PYRIDONES OR PYRIDINETHIONES ELI LILLY AND COMPANY (US) 1980-11-25 — — US disclosed
US-4152136-A HERBICIDES ELI LILLY AND COMPANY (US) 1979-05-01 — — US disclosed
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