SCHEMBL10945260

SCHEMBL10945260

CCC(O)(CC)C(=O)c1ccc2[nH]c3ccc(C(=O)C(O)(CC)CC)cc3c(=O)c(=O)c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.43
▸ ALDH1A1 P00352 9/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ MAPT P10636 2/20 0.43
▸ HCRTR1 O43613 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ APEX1 P27695 1/20 0.42
▸ HPGD P15428 6/20 0.42
▸ HSD17B10 Q99714 5/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ KIF11 P52732 2/20 0.40
▸ GAA P10253 2/20 0.40
▸ PSMD14 O00487 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL10942675 0.97 KDM4E (0.43) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL10945548 0.93 ALDH1A1 (0.50) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL10941773 0.90 GAA (0.51) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL10947121 0.83 KIF11 (0.46) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL10944475 0.80 IMPDH2 (0.46) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL11209431 0.79 NPC1 (0.49) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL10943083 0.78 KDM4E (0.43) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL10942850 0.77 IMPDH2 (0.53) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL10944937 0.76 NPC1 (0.52) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL10943742 0.76 CYP1A2 (0.38) KDM4EALDH1A1MEN1KMT2AMAPT

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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