SCHEMBL6313239

SCHEMBL6313239

COc1cc2c(C)nc(O)c(O)c2cc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.49
RAC1 P63000 4/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
GAA P10253 2/20 0.45
POLB P06746 1/20 0.45
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 2/20 0.41
PDE4A P27815 1/20 0.41
PDE4D Q08499 1/20 0.41
ALDH1A1 P00352 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
SMPD3 Q9NY59 1/20 0.40
USP2 O75604 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PDE10A Q9Y233 3/20 0.38
PDE3B Q13370 1/20 0.38

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
SCHEMBL7308411 0.81 KDM4E (0.46) KDM4ERAC1MEN1KMT2AGAA
SCHEMBL7434923 0.81 KDM4E (0.46) KDM4ERAC1MEN1KMT2AGAA
SCHEMBL7309710 0.81 KDM4E (0.46) KDM4ERAC1MEN1KMT2AGAA
SCHEMBL7318410 0.79 PDE3B (0.46) KDM4ERAC1MEN1KMT2AGAA
SCHEMBL7312102 0.79 PDE3B (0.46) KDM4ERAC1MEN1KMT2AGAA
Bromide SCHEMBL7318711 0.79 KDM4E (0.47) KDM4ERAC1MEN1KMT2AGAA
SCHEMBL12325390 0.78 CYP3A4 (0.46) KDM4ERAC1MEN1KMT2AGAA
Hydrochloric Acid SCHEMBL27947697 0.78 KDM4E (0.46) KDM4ERAC1MEN1KMT2AGAA
SCHEMBL7447294 0.76 KDM4E (0.42) KDM4ERAC1MEN1KMT2AGAA
SCHEMBL7412702 0.75 KDM4E (0.44) KDM4ERAC1MEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887820-B1 For producing optically active secondary alcohols, producing optically active compounds useful for various utilities such as intermediates for synthesizing pharmaceutical agents, liquid crystal materials and agents for optical resolution JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2005-05-03 US disclosed
EP-0916637-B1 PROCESS FOR PREPARATING OPTICALLY ACTIVE COMPOUNDS JAPAN SCIENCE & TECH AGENCY (JP) 2005-04-20 EP disclosed
EP-1300381-A1 Process for preparing optically active alcohols Japan Science and Technology Corporation (JP) 2003-04-09 EP disclosed
US-6184381-B1 USEFUL AS INTERMEDIATES FOR SYNTHESIZING PHARMACEUTICAL CHEMICALS, LIQUID CRYSTAL MATERIALS AND AGENTS FOR OPTICAL RESOLUTION, REDUCTION, KETONES TO ALCOHOL, IMINES TO AMINES JAPAN SCIENCE & TECHNOLOGY CORP. (JP) 2001-02-06 US disclosed
EP-0916637-A1 PROCESS FOR PREPARATING OPTICALLY ACTIVE COMPOUNDS Japan Science and Technology Corporation (JP) 1999-05-19 EP disclosed