SCHEMBL429540

SCHEMBL429540

OCCc1ccccc1-c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.58
KMT2A Q03164 1/20 0.53
PTGER1 P34995 3/20 0.50
PTGER4 P35408 3/20 0.50
PTGER3 P43115 3/20 0.50
PTGER2 P43116 3/20 0.50
PDCD1 Q15116 1/20 0.50
CD274 Q9NZQ7 1/20 0.50
FOLH1 Q04609 1/20 0.50
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
BCL2L1 Q07817 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45

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
SCHEMBL27840283 1.00 DPP4 (0.58) DPP4KMT2APTGER1PTGER4PTGER3
SCHEMBL10609360 0.93 DPP4 (0.50) DPP4KMT2APTGER1PTGER4PTGER3
SCHEMBL11333152 0.87 DPP4 (0.65) DPP4KMT2APTGER1PTGER4PTGER3
SCHEMBL5659211 0.87 KMT2A (0.47) DPP4KMT2APTGER1PTGER4PTGER3
SCHEMBL1535892 0.86 DPP4 (0.54) DPP4KMT2APTGER1PTGER4PTGER3
Tetrahydrofuran SCHEMBL27878929 0.85 DPP4 (0.44) DPP4KMT2APTGER1PTGER4PTGER3
SCHEMBL11334269 0.85 DPP4 (0.52) DPP4KMT2APTGER1PTGER4PTGER3
SCHEMBL28332553 0.85 TDP1 (0.54) DPP4PTGER1PTGER4PTGER3PTGER2
SCHEMBL29584523 0.85 TDP1 (0.54) DPP4PTGER1PTGER4PTGER3PTGER2
SCHEMBL2865404 0.85 ABL1 (0.50) DPP4KMT2APTGER1PTGER4PTGER3

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 366 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114394887-A Phenyloxyethanol compound and preparation method thereof 江苏锐鸣材料科技有限公司 2022-04-26 CN claimed
CN-109082280-A A kind of preparation method of liquid crystal material 宁夏中星显示材料有限公司 2018-12-25 CN claimed
CN-107488209-A Gelator and its hydrogel prepare and application 四川大学 2017-12-19 CN claimed
CN-103059015-B Biphenylylmethylcarbinol derivative, preparation method and the application in treatment autoimmune disorder thereof SICHUAN UNIVERSITY (CN) 2016-01-13 CN claimed
CN-103923057-B A kind of Biphenylylmethylcarbinol intermediate 2-bromo-3, the purification process of 4-methylenedioxy group-5-methoxyl methyl benzoate SUZHOU TIANMA FINE CHEMICAL PRODUCT CO., LTD. (CN) 2015-12-30 CN claimed
CN-105111195-A Tacrine-bifendate heterocomplex as well as preparation method and application thereof UNIV HENAN 2015-12-02 CN claimed
CN-104788310-A Preparation method of acrylic ester material for optical films ZHANGJIAGANG KANGDE XIN PHOTOELECTRIC MATERIAL CO LTD 2015-07-22 CN claimed
CN-103539667-B Preparation method of low chroma o-phenyl phenoxyethyl acrylic ester SHANGHAI WEIKAI CHEMICALS CO 2015-06-17 CN claimed
CN-104193635-A Synthesis method of pregabalin TAICANG YUNTONG BIOCHEMICAL ENGINEERING CO LTD 2014-12-10 CN claimed
CN-103923057-A Method for purifying intermediate 2-bromine-3, 4-methylidynel dioxo-5-methoxy methyl benzoate of bifendate SUZHOU TIANMA SPECIALTY CHEMICALS CO LTD 2014-07-16 CN claimed
CN-1412185-A Production method of halogenated hexahydroxydiphenic derivative and its medicinal application CHANG JUNBIAO (CN) 2003-04-23 CN claimed
CN-1319595-A Method for producing optically active 3-hydroxy-gamna-butyrolactone KURARAY CO (JP) 2001-10-31 CN claimed
CN-1070469-C Optical resolution method of (+/-) -3, 4-dihydroxybutyric acid KURARAY CO (JP) 2001-09-05 CN claimed
CN-1303848-A Method for synthesizing beta-biphenyl diester INST OF CHEMISTRY HE NAN PROV (CN) 2001-07-18 CN claimed
CN-1184806-A Optical resolution method of (+/-) -3, 4-dihydroxybutyric acid KURARAY CO (JP) 1998-06-17 CN claimed
CN-1073438-A The improvement synthetic method of Biphenylylmethylcarbinol INST MATERIA MEDICA CAMS (CN) 1993-06-23 CN claimed
CN-1015713-B PREPN. OF METHYL BENZOATE SHANGHAI NO 15 PHARMACEUTICAL (CN) 1992-03-04 CN claimed
CN-1034368-A From the bromination reaction by product of Biphenylylmethylcarbinol, obtain the method for cyclocomplex again SHANGHAI NO 15 PHARMACEUTICAL (CN) 1989-08-02 CN claimed
CN-86107486-A The synthetic method of Biphenylylmethylcarbinol 1988-05-11 CN claimed
CN-85100439-A The ring-closure reaction method of 3-methoxyl group-4.5-methyl dihydroxy benzoate 1986-07-16 CN claimed