SCHEMBL546542

SCHEMBL546542

COC(SOSC(OC)c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.38
EPHX1 P07099 2/20 0.36
THRB P10828 1/20 0.36
DPP4 P27487 2/20 0.33
F2 P00734 1/20 0.33
TSHR P16473 1/20 0.33
CA4 P22748 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.32
ACP3 P15309 1/20 0.32
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
ADRA2A P08913 1/20 0.32
ADORA3 P0DMS8 1/20 0.32

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
Methylene Chloride SCHEMBL28192145 0.92 KMT2A (0.33) KMT2AEPHX1THRBTSHRSMN1; SMN2
SCHEMBL28784937 0.82 SMN1; SMN2 (0.36) TSHRSMN1; SMN2ALDH1A1HTR2AKCNH2
SCHEMBL1782470 0.81 KMT2A (0.40) KMT2AEPHX1THRBDPP4F2
SCHEMBL6651178 0.81 KMT2A (0.40) KMT2AEPHX1THRBDPP4F2
SCHEMBL31499299 0.81 KMT2A (0.40) KMT2AEPHX1THRBDPP4F2
SCHEMBL5503227 0.77 KMT2A (0.38) KMT2AEPHX1THRBDPP4F2
SCHEMBL24002249 0.74 THRB (0.38) KMT2AEPHX1THRBL3MBTL1ALDH1A1
SCHEMBL20610222 0.74 ALDH1A1 (0.50) KMT2ATSHRALDH1A1CYP2D6
SCHEMBL913100 0.71 KMT2A (0.41) KMT2ADPP4F2TSHRL3MBTL1
SCHEMBL24243366 0.71 LMNA (0.36) KMT2AEPHX1THRBTSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104530417-B A kind of multiple functionalized H types polyethyleneglycol derivative and preparation method thereof 厦门赛诺邦格生物科技股份有限公司 2017-09-08 CN claimed
CN-104530415-B A kind of different functionalization Y types polyethyleneglycol derivative, preparation method and its bio-related substance 厦门赛诺邦格生物科技股份有限公司 2017-09-01 CN claimed
CN-104530415-A Hetero-functionalized Y-type polyethylene glycol derivative, preparation method and biologically related substance thereof XIAMEN SINOPEG BIOTECH INC 2015-04-22 CN claimed
CN-104530417-A Multifunctional H-type polyethylene glycol derivative and preparation method thereof XIAMEN SINOPEG BIOTECH INC 2015-04-22 CN claimed
CN-104109235-A Mono-functionalized polyethylene glycol with nitrogen atom branched center and its preparation method and biologically-relevant matter XIAMEN SINOPEG BIOTECH CO LTD 2014-10-22 CN claimed
EP-2465541-B1 Improved processes for making hydrazides WYETH LLC (US) 2018-07-18 EP disclosed
CN-108047287-A For synthesizing the intermediate of Calicheamicin derivative and method 辉瑞大药厂 2018-05-18 CN disclosed
CN-104725628-B A kind of single functionalization branched polyethylene glycol, preparation method and its bio-related substance containing degradable group 厦门赛诺邦格生物科技股份有限公司 2018-04-17 CN disclosed
CN-105683159-B Intermediates and methods for the synthesis of calicheamicin derivatives 辉瑞大药厂 2017-12-19 CN disclosed
CN-104530417-B A kind of multiple functionalized H types polyethyleneglycol derivative and preparation method thereof 厦门赛诺邦格生物科技股份有限公司 2017-09-08 CN disclosed
CN-104530415-B A kind of different functionalization Y types polyethyleneglycol derivative, preparation method and its bio-related substance 厦门赛诺邦格生物科技股份有限公司 2017-09-01 CN disclosed
CN-104530413-B A kind of bio-related substance of multiple functionalized H types polyethyleneglycol derivative modification 厦门赛诺邦格生物科技股份有限公司 2017-08-25 CN disclosed
US-20040096893-A1 Functionalised silicon surfaces, and method for their production BOUKHERROUB RABAH (CA) 2004-05-20 US disclosed
US-6677163-B1 SIMPLE AND DURABLE IMMOBILIZATION OF BIOMOLECULES NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2004-01-13 US disclosed
EP-0716604-A4 THIOL-DERIVATIZED NUCLEOSIDES AND OLIGONUCLEOSIDES ISIS PHARMACEUTICALS INC (US) 2000-12-27 EP disclosed
WO-2000068257-A1 C-LINKED NEOGLYCOPEPTIDES, THEIR COMBINATORIAL SYNTHESIS AND USE NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2000-11-16 WO disclosed
EP-0716604-A1 THIOL-DERIVATIZED NUCLEOSIDES AND OLIGONUCLEOSIDES ISIS PHARMACEUTICALS, INC. (US) 1996-06-19 EP disclosed
WO-1996014873-A2 COVALENTLY BOUND β-GLUCAN CONJUGATES IN TARGETED DELIVERY SRI INTERNATIONAL (US) 1996-05-23 WO disclosed
WO-1995006474-A1 THIOL-DERIVATIZED NUCLEOSIDES AND OLIGONUCLEOSIDES ISIS PHARMACEUTICALS, INC. (US) 1995-03-09 WO disclosed
EP-0132101-A1 2-Heterocycloalkylthiopenem derivatives PFIZER INC. (US) 1985-01-23 EP disclosed