SCHEMBL4386227

SCHEMBL4386227

COc1ccc(C(=O)Oc2ccc3c(C)cc(=O)oc3c2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.79
▸ ALDH1A1 P00352 9/20 0.79
▸ KMT2A Q03164 8/20 0.79
▸ GAA P10253 6/20 0.79
▸ GLA P06280 5/20 0.79
▸ MAPT P10636 4/20 0.79
▸ NPBWR1 P48145 1/20 0.79
▸ HPGD P15428 5/20 0.70
▸ HSD17B10 Q99714 3/20 0.70
▸ POLB P06746 1/20 0.69
▸ GBA1 P04062 2/20 0.67
▸ F2 P00734 1/20 0.65
▸ NPC1 O15118 2/20 0.60
▸ MEN1 O00255 2/20 0.60
▸ CASP3 P42574 1/20 0.60
▸ RAB9A P51151 1/20 0.60
▸ SENP8 Q96LD8 1/20 0.60
▸ SENP7 Q9BQF6 1/20 0.60
▸ SENP6 Q9GZR1 1/20 0.60
▸ ALDH2 P05091 1/20 0.57

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
SCHEMBL27860823 0.89 KDM4E (0.77) KDM4EALDH1A1KMT2AGAAGLA
SCHEMBL662006 0.88 KDM4E (1.00) KDM4EALDH1A1KMT2AGAAGLA
SCHEMBL29700876 0.83 ALDH1A1 (0.69) KDM4EALDH1A1KMT2AGAAGLA
Hymecromone Methyl Ether SCHEMBL314248 0.83 KDM4E (1.00) KDM4EALDH1A1KMT2AGAAGLA
Hymecromone Methyl Ether SCHEMBL31103478 0.83 KDM4E (1.00) KDM4EALDH1A1KMT2AGAAGLA
Hydrochloric Acid SCHEMBL29554468 0.83 ALDH1A1 (0.68) KDM4EALDH1A1KMT2AGAAGLA
SCHEMBL289400 0.82 KDM4E (0.67) KDM4EALDH1A1KMT2AGAAGLA
SCHEMBL6320632 0.81 POLB (1.00) KDM4EALDH1A1KMT2AGAAMAPT
Hydrochloric Acid SCHEMBL7641797 0.81 KDM4E (0.65) KDM4EALDH1A1KMT2AGAAGLA
SCHEMBL335474 0.81 KDM4E (1.00) KDM4EALDH1A1KMT2AGAAGLA

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-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 — — US disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 — — US disclosed
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