SCHEMBL10784792

SCHEMBL10784792

COc1ccc(CCC(=O)CCc2ccc(OC)cc2OC)c(OC)c1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.55
APLNR P35414 1/20 0.54
NPC1 O15118 1/20 0.54
PKM P14618 1/20 0.54
RAB9A P51151 1/20 0.54
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
CNR1 P21554 3/20 0.49
ALDH1A1 P00352 1/20 0.49
F2RL1 P55085 1/20 0.49
CNR2 P34972 1/20 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
SCHEMBL266527 0.88 NPC1 (0.58) POLBAPLNRNPC1PKMRAB9A
SCHEMBL490637 0.88 POLB (0.71) POLBAPLNRNPC1PKMRAB9A
SCHEMBL9668685 0.88 F2RL1 (0.53) POLBAPLNRNPC1PKMRAB9A
SCHEMBL585472 0.87 APLNR (0.56) POLBAPLNRNPC1PKMRAB9A
SCHEMBL2398226 0.87 POLB (0.53) POLBAPLNRNPC1PKMRAB9A
SCHEMBL28028759 0.87 MTNR1A (0.59) POLBAPLNRNPC1PKMRAB9A
SCHEMBL7332981 0.86 HSD17B10 (0.63) POLBNPC1PKMRAB9AHSD17B10
SCHEMBL11576234 0.85 POLB (0.51) POLBAPLNRNPC1PKMRAB9A
SCHEMBL7194960 0.85 RAB9A (0.72) POLBAPLNRNPC1PKMRAB9A
SCHEMBL10915038 0.83 MTNR1A (0.62) POLBAPLNRNPC1PKMRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105906617-B Modulators of HEC1 activity and methods thereof 泰纬生命科技股份有限公司 2018-09-04 CN disclosed
CN-108484574-A The preparation and application of tetrahydro isoquinoline derivative 广东医科大学 2018-09-04 CN disclosed
CN-104254534-B Modulators of HEC1 activity and methods thereof 泰纬生命科技股份有限公司 2017-07-14 CN disclosed
CN-105906617-A Modulators of HEC1 activity and methods thereof 泰纬生命科技股份有限公司 2016-08-31 CN disclosed
CN-103038231-B Modulators of HEC1 activity and methods thereof Taivex Therapeutics Corp. (CN) 2016-04-20 CN disclosed
CN-104254534-A Modulators of HEC1 activity and methods thereof TAIVEX THERAPEUTICS CORP 2014-12-31 CN disclosed
CN-102264716-A Substituted benzfurochromenes and related compounds for the prevention and treatment of bone related disorders 2011-11-30 CN disclosed
US-4647446-A Rapid brain scanning radiopharmaceutical THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1987-03-03 US disclosed