SCHEMBL29957670

SCHEMBL29957670

CC(=O)n1c(C=O)c(Cl)c2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.58
▸ MAPT P10636 4/20 0.52
▸ KDM4E B2RXH2 4/20 0.52
▸ RAB9A P51151 4/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ NPC1 O15118 3/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ TSHR P16473 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ LMNA P02545 2/20 0.47
▸ GLA P06280 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.46
▸ CRHBP P24387 1/20 0.45
▸ CRHR2 Q13324 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL15959921 0.82 KDM4E (0.65) POLBMAPTKDM4ERAB9AKMT2A
SCHEMBL15959922 0.77 POLB (0.53) POLBMAPTKDM4ERAB9AKMT2A
SCHEMBL28165403 0.76 L3MBTL1 (0.54) POLBMAPTKDM4ERAB9ANPC1
SCHEMBL29771433 0.74 POLB (1.00) POLBMAPTKDM4ERAB9AKMT2A
SCHEMBL29787117 0.74 POLB (1.00) POLBMAPTKDM4ERAB9AKMT2A
SCHEMBL153365 0.74 POLB (1.00) POLBMAPTKDM4ERAB9AKMT2A
SCHEMBL28165405 0.73 KMT2A (0.53) MAPTKDM4EKMT2ATDP1ALDH1A1
SCHEMBL28433232 0.73 HTT (0.42) POLBMAPTKDM4ERAB9AKMT2A
SCHEMBL28441990 0.73 ALDH1A1 (0.46) POLBMAPTKDM4ERAB9AKMT2A
SCHEMBL28438215 0.72 POLB (0.43) POLBMAPTRAB9AKMT2ANPC1

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
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