SCHEMBL10941773

SCHEMBL10941773

CCC(O)(CC)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 4/20 0.51
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ POLB P06746 2/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ CASP6 P55212 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ ALDH1A1 P00352 6/20 0.50
▸ IMPDH2 P12268 6/20 0.50
▸ KDM4E B2RXH2 5/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ HCRTR1 O43613 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ P2RY12 Q9H244 2/20 0.49
▸ ABCG2 Q9UNQ0 1/20 0.48
▸ GLA P06280 2/20 0.48
▸ HTT P42858 2/20 0.48
▸ HPGD P15428 2/20 0.47
▸ LMNA P02545 1/20 0.47

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
SCHEMBL10945548 0.97 ALDH1A1 (0.50) GAAMEN1KMT2APOLBNPC1
SCHEMBL10942675 0.93 KDM4E (0.43) GAAMEN1KMT2APOLBNPC1
SCHEMBL10945260 0.90 KDM4E (0.43) GAAMEN1KMT2APOLBNPC1
SCHEMBL10942326 0.85 IMPDH2 (0.56) GAAMEN1KMT2APOLBNPC1
SCHEMBL10942850 0.82 IMPDH2 (0.53) GAAMEN1KMT2APOLBNPC1
SCHEMBL10945711 0.79 IMPDH2 (0.53) GAAMEN1KMT2APOLBNPC1
SCHEMBL10941059 0.79 ABCG2 (0.55) GAAMEN1KMT2APOLBNPC1
SCHEMBL17874531 0.77 GAA (0.63) GAAMEN1KMT2APOLBNPC1
SCHEMBL10944475 0.77 IMPDH2 (0.46) GAAMEN1KMT2APOLBNPC1
SCHEMBL10947215 0.76 IMPDH2 (0.50) GAAMEN1KMT2APOLBNPC1

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-4496447-A PHOTOPOLYMERIZATION OF UNSATURATED COMPOUNDS AND FOR CURING PRINTING INKS MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1985-01-29 — — US disclosed
US-4374984-A Aromatic-aliphatic ketones useful as photoinitiators MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1983-02-22 — — US disclosed
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