SCHEMBL6013084

SCHEMBL6013084

COc1ccc(Oc2cccc3ccccc23)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.55
ALDH1A1 P00352 3/20 0.55
HTT P42858 3/20 0.55
MAPK1 P28482 1/20 0.55
RAB9A P51151 2/20 0.53
LTA4H P09960 1/20 0.52
LMNA P02545 5/20 0.51
POLB P06746 2/20 0.51
CYP1A2 P05177 2/20 0.51
GAA P10253 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
SLC6A2 P23975 2/20 0.50
SLC6A4 P31645 2/20 0.50
MAPT P10636 2/20 0.50
SLC6A3 Q01959 1/20 0.49
CARM1 Q86X55 1/20 0.48
PRMT6 Q96LA8 1/20 0.48
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48

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
SCHEMBL2078871 0.90 L3MBTL1 (0.54) L3MBTL1ALDH1A1HTTMAPK1LMNA
SCHEMBL8737442 0.85 SLC6A4 (0.49) L3MBTL1ALDH1A1HTTMAPK1LMNA
SCHEMBL29148791 0.84 L3MBTL1 (0.50) L3MBTL1ALDH1A1HTTMAPK1LMNA
SCHEMBL7203253 0.84 CYP1A2 (0.66) L3MBTL1ALDH1A1HTTRAB9ALMNA
SCHEMBL441860 0.84 KCNA3 (0.58) L3MBTL1ALDH1A1HTTMAPK1LTA4H
SCHEMBL29860318 0.84 KCNA3 (0.58) L3MBTL1ALDH1A1HTTMAPK1LTA4H
Water SCHEMBL27705785 0.82 KCNA3 (0.56) L3MBTL1ALDH1A1HTTMAPK1LTA4H
SCHEMBL7220606 0.81 LTA4H (0.52) L3MBTL1ALDH1A1HTTMAPK1LTA4H
SCHEMBL31571623 0.81 NCOA1 (0.53) L3MBTL1ALDH1A1HTTRAB9ALMNA
SCHEMBL1880664 0.81 L3MBTL1 (0.48) L3MBTL1ALDH1A1HTTMAPK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110760057-A Low-dielectric-loss high-pressure-resistant moisture-proof unsaturated polyester resin and preparation method thereof 南通华如绝缘材料有限公司 2020-02-07 CN claimed
WO-2006081384-A2 HETEROGENEOUS COPPER CATALYSTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-08-03 WO disclosed
US-20060165580-A1 Heterogeneous copper catalysts THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-07-27 US disclosed
US-4391995-A 4-Phenoxy-phenoxy-alkane-carboxylic acid derivatives and process for their manufacture HOECHST AKTIENGESELLSCHAFT (DE) 1983-07-05 US disclosed
US-4301295-A ANTILIPEMIC AND ANTICHOLESTEROL AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1981-11-17 US disclosed
US-4238626-A ANTICHOLESTEROL AND ANTILIPEMIC AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1980-12-09 US disclosed