SCHEMBL27990722

SCHEMBL27990722

O=C(Oc1c[nH]nn1)c1ccc(C(=O)Oc2c[nH]nn2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.38
KMT2A Q03164 8/20 0.35
MAPT P10636 5/20 0.35
SENP1 Q9P0U3 1/20 0.34
PARP10 Q53GL7 1/20 0.34
LMNA P02545 2/20 0.34
MEN1 O00255 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
F2 P00734 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
TMPRSS15 P98073 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL28015157 0.98 HSD17B10 (0.37) HSD17B10KMT2AMAPTSENP1PARP10
SCHEMBL28054634 0.93 TSHR (0.41) HSD17B10KMT2AMAPTSMN1; SMN2ALDH1A1
Sulfuric Acid SCHEMBL28590324 0.93 MAPT (0.36) HSD17B10KMT2AMAPTSENP1LMNA
Sulfuric Acid SCHEMBL28600605 0.93 MAPT (0.36) HSD17B10KMT2AMAPTSENP1LMNA
SCHEMBL28044876 0.91 TSHR (0.40) HSD17B10KMT2AMAPTLMNASMN1; SMN2
SCHEMBL28013539 0.91 TSHR (0.40) HSD17B10KMT2AMAPTLMNASMN1; SMN2
SCHEMBL28005995 0.91 TSHR (0.40) HSD17B10KMT2AMAPTLMNASMN1; SMN2
SCHEMBL28065967 0.91 TSHR (0.40) HSD17B10KMT2AMAPTLMNASMN1; SMN2
SCHEMBL17495602 0.91 KMT2A (0.45) HSD17B10KMT2AMAPTPARP10LMNA
Sulfuric Acid SCHEMBL28590325 0.87 TP53 (0.36) KMT2AMAPTMEN1SMN1; SMN2TMPRSS15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104610380-B Triazole terephthalic acid (TPA) cobalt complex of phenyl triiodide amine three with potential fluorescent material and preparation method thereof 天津师范大学 2017-08-11 CN claimed
CN-106187925-A The double triazole terephthalic acid compounds monocrystalline of 4H thioether and application 天津师范大学 2016-12-07 CN claimed
CN-104610324-B There are phenyl triiodide amine three triazole terephthalic acid (TPA) cadmium complexes of potential fluorescent material and preparation method thereof TIANJIN NORMAL UNIVERSITY (CN) 2016-05-18 CN claimed
CN-105566359-A 1,4-dimethyl-2,5-dimethylene bis(triazole) zinc terephthalate complex monocrystal and applications thereof UNIV TIANJIN 2016-05-11 CN claimed
CN-105524085-A 1, 4-dimethyl-2, 5-dimethylene bistriazole terephthalic acid three-dimensional zinc complex single crystal and application thereof UNIV TIANJIN 2016-04-27 CN claimed
CN-105524086-A Potential fluorescent material tetraphenyl ethylene tetra-triazole terephthalic acid zinc complex and preparation method thereof UNIV TIANJIN 2016-04-27 CN claimed
CN-105524088-A Anthracycline bistriazole terephthalic acid inclusion diethyl formamide zinc complex single crystal and application thereof UNIV TIANJIN 2016-04-27 CN claimed
CN-105418523-A 1,4-dimethyl-2,5-dimethylene bis(triazole)terephthalic acid single crystal and application UNIV TIANJIN 2016-03-23 CN claimed
CN-105294743-A 4H sulfide double triazole terephthalic acid zinc complex single crystal and preparation method as well as application thereof UNIV TIANJIN NORMAL 2016-02-03 CN claimed
CN-104610303-A Zinc triiodo phenylamine tri-triazole terephthalic acid complex used as potential fluorescent material and preparation method thereof UNIV TIANJIN NORMAL 2015-05-13 CN claimed
CN-104610299-A Zinc naphthalene bistriazole terephthalic acid complex used as potential fluorescent material and preparation method thereof UNIV TIANJIN NORMAL 2015-05-13 CN claimed
CN-104610302-A Antharcycline bis-triazole terephthalic acid zinc complex with potential fluorescent material and preparation method of antharcycline bis-triazole terephthalic acid zinc complex UNIV TIANJIN NORMAL 2015-05-13 CN claimed
CN-104610295-A Potential fluorescent material containing tetraphenylethylene tetra-triazole zinc terephthalate complex and preparation method thereof UNIV TIANJIN NORMAL 2015-05-13 CN claimed
CN-104610380-B Triazole terephthalic acid (TPA) cobalt complex of phenyl triiodide amine three with potential fluorescent material and preparation method thereof 天津师范大学 2017-08-11 CN disclosed
CN-104610380-B Triazole terephthalic acid (TPA) cobalt complex of phenyl triiodide amine three with potential fluorescent material and preparation method thereof 天津师范大学 2017-08-11 CN disclosed
CN-104610380-B Triazole terephthalic acid (TPA) cobalt complex of phenyl triiodide amine three with potential fluorescent material and preparation method thereof 天津师范大学 2017-08-11 CN disclosed
CN-104610303-A Zinc triiodo phenylamine tri-triazole terephthalic acid complex used as potential fluorescent material and preparation method thereof UNIV TIANJIN NORMAL 2015-05-13 CN disclosed
CN-104610299-A Zinc naphthalene bistriazole terephthalic acid complex used as potential fluorescent material and preparation method thereof UNIV TIANJIN NORMAL 2015-05-13 CN disclosed
CN-104610302-A Antharcycline bis-triazole terephthalic acid zinc complex with potential fluorescent material and preparation method of antharcycline bis-triazole terephthalic acid zinc complex UNIV TIANJIN NORMAL 2015-05-13 CN disclosed
CN-104610295-A Potential fluorescent material containing tetraphenylethylene tetra-triazole zinc terephthalate complex and preparation method thereof UNIV TIANJIN NORMAL 2015-05-13 CN disclosed