SCHEMBL1743359

SCHEMBL1743359

COc1cc(OC)cc(-c2cc3ccc(O)cc3o2)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALCRL Q16602 2/20 0.69
PDE4B Q07343 2/20 0.66
PDE4D Q08499 2/20 0.66
TYR P14679 1/20 0.66
PTGS1 P23219 1/20 0.66
PTGS2 P35354 1/20 0.66
SHBG P04278 1/20 0.63
PTPN1 P18031 2/20 0.62
ABL1 P00519 2/20 0.57
ABCB1 P08183 2/20 0.57
BCR P11274 2/20 0.57
ALOX5 P09917 2/20 0.56
ALOX15 P16050 2/20 0.56
ALOX12 P18054 2/20 0.56
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
MIF P14174 2/20 0.55
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
RXFP1 Q9HBX9 1/20 0.55

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
SCHEMBL30176916 0.81 HIF1A (0.52) CALCRLPTPN1ABCB1NPC1CYP3A4
SCHEMBL28887391 0.81 HIF1A (0.52) CALCRLPTPN1ABCB1NPC1CYP3A4
SCHEMBL10800535 0.80 PTPN1 (0.77) CALCRLPDE4BPDE4DTYRPTGS1
Moracin M SCHEMBL1740981 0.80 PDE4D (1.00) CALCRLPDE4BPDE4DTYRPTGS1
Moracin M SCHEMBL29979946 0.80 PDE4D (1.00) CALCRLPDE4BPDE4DTYRPTGS1
SCHEMBL4404220 0.80 CYP3A4 (0.80) ABCB1ALOX5MEN1KMT2ANPC1
SCHEMBL28843685 0.80 MIF (0.80) PTGS1MEN1KMT2AMIFNPC1
SCHEMBL20147031 0.79 CALCRL (0.74) CALCRLPDE4BPDE4DTYRPTGS1
SCHEMBL28792949 0.79 CASP3 (0.63) ALOX5MEN1KMT2ANPC1RAB9A
SCHEMBL29742911 0.79 CASP3 (0.63) ALOX5MEN1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104447646-B A kind of method complete synthesis for natural product Moracin M 中科院广州化学有限公司 2016-08-31 CN claimed
CN-104447646-A Total synthesis method for natural product Moracin M CAS GUANGZHOU CHEMISTRY CO LTD 2015-03-25 CN claimed
EP-2388255-A1 Polysubstituted benzofurans and medicinal applications thereof Ikerchem, S.L. (ES) 2011-11-23 EP claimed
US-8038466-B1 Power receptacle with enlarged heat dissipation path formed on mating face and power connector assembly thereof ALLTOP ELECTRONICS (SUZHOU) CO., LTD (CN) 2011-10-18 US claimed
CN-115181082-B Synthetic method of natural molecule Moracin M 江苏集萃分子工程研究院有限公司 2023-11-03 CN disclosed
CN-112358459-B Preparation method of benzofuran compound 心远(广州)药物研究有限公司 2023-01-17 CN disclosed
CN-115181082-A Synthetic method of natural molecule Moracin M 江苏集萃分子工程研究院有限公司 2022-10-14 CN disclosed
CN-112358459-A Preparation method of benzofuran compound 心远(广州)药物研究有限公司 2021-02-12 CN disclosed
CN-110894192-A Preparation method of benzofuran compound 心远(广州)药物研究有限公司 2020-03-20 CN disclosed
CN-104447646-B A kind of method complete synthesis for natural product Moracin M 中科院广州化学有限公司 2016-08-31 CN disclosed
CN-104447646-A Total synthesis method for natural product Moracin M CAS GUANGZHOU CHEMISTRY CO LTD 2015-03-25 CN disclosed
EP-2388255-A1 Polysubstituted benzofurans and medicinal applications thereof Ikerchem, S.L. (ES) 2011-11-23 EP disclosed
EP-2388255-A1 Polysubstituted benzofurans and medicinal applications thereof Ikerchem, S.L. (ES) 2011-11-23 EP disclosed
US-8038466-B1 Power receptacle with enlarged heat dissipation path formed on mating face and power connector assembly thereof ALLTOP ELECTRONICS (SUZHOU) CO., LTD (CN) 2011-10-18 US disclosed