SCHEMBL3282817

SCHEMBL3282817

O=C(O)C1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)C1N=Nc1ccc(S(=O)(=O)[O-])cc1.O=C(O)C1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)C1N=Nc1ccc(S(=O)(=O)[O-])cc1.O=C(O)C1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)C1N=Nc1ccc(S(=O)(=O)[O-])cc1.[Al+3]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.47
▸ KMT2A Q03164 9/20 0.47
▸ MAPT P10636 6/20 0.47
▸ CYP1A2 P05177 2/20 0.47
▸ GAA P10253 1/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ LMNA P02545 4/20 0.42
▸ NPC1 O15118 4/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ POLB P06746 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ ATM Q13315 1/20 0.40
▸ CYP2D6 P10635 2/20 0.37
▸ CYP2C9 P11712 1/20 0.36
▸ PHLPP2 Q6ZVD8 1/20 0.34
▸ CYP2C19 P33261 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
SCHEMBL839392 0.94 MEN1 (0.52) MEN1KMT2AMAPTCYP1A2GAA
SCHEMBL839391 0.94 MEN1 (0.52) MEN1KMT2AMAPTCYP1A2GAA
SCHEMBL185928 0.94 MEN1 (0.52) MEN1KMT2AMAPTCYP1A2GAA
SCHEMBL29376127 0.93 MEN1 (0.54) MEN1KMT2AMAPTCYP1A2GAA
SCHEMBL185927 0.93 MEN1 (0.51) MEN1KMT2AMAPTCYP1A2GAA
SCHEMBL28836941 0.93 MEN1 (0.51) MEN1KMT2AMAPTCYP1A2GAA
SCHEMBL5355831 0.90 MEN1 (0.58) MEN1KMT2AMAPTCYP1A2GAA
SCHEMBL5355824 0.90 MEN1 (0.58) MEN1KMT2AMAPTCYP1A2GAA
SCHEMBL5360382 0.90 MAPT (0.53) MEN1KMT2AMAPTCYP1A2GAA
SCHEMBL5360387 0.90 MAPT (0.53) MEN1KMT2AMAPTCYP1A2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116836567-B Preparation method of dust-free pigment 蓬莱新光颜料化工有限公司 2023-11-10 — — CN claimed
CN-116836567-A Preparation method of dust-free pigment 蓬莱新光颜料化工有限公司 2023-10-03 — — CN claimed
CN-115595681-A Fibers having physical properties for encoding 伊士曼化工公司(US) 2023-01-13 — — CN claimed
EP-3575453-A1 ACETATE TOW BAND COMPRISING STANDARD FIBRES AND IDENTIFICATION FIBRES Eastman Chemical Company (US) 2019-12-04 — — EP claimed
EP-3161192-B1 METHOD OF CHARACTERIZING A FIBER SAMPLE EASTMAN CHEM CO (US) 2019-11-13 — — EP claimed
EP-3161193-B1 ACETATE TOW BAND WITH CHEMICAL MARKERS AND PHYSICAL FEATURES USED FOR CODING EASTMAN CHEM CO (US) 2019-10-23 — — EP claimed
EP-3161190-B1 METHOD FOR CHARACTERIZING A FIBER SAMPLE EASTMAN CHEM CO (US) 2019-09-04 — — EP claimed
US-10127410-B2 Fibers with physical features used for coding EASTMAN CHEMICAL COMPANY (US) 2018-11-13 — — US claimed
US-20180144161-A1 FIBERS WITH PHYSICAL FEATURES USED FOR CODING EASTMAN CHEMICAL COMPANY (US) 2018-05-24 — — US claimed
US-9972224-B2 Fibers with multicomponent fibers used for coding EASTMAN CHEMICAL COMPANY (US) 2018-05-15 — — US claimed
EP-3161193-A2 FIBERS WITH CHEMICAL MARKERS AND PHYSICAL FEATURES USED FOR CODING Eastman Chemical Company (US) 2017-05-03 — — EP claimed
EP-3161190-A1 FIBERS WITH PHYSICAL FEATURES USED FOR CODING Eastman Chemical Company (US) 2017-05-03 — — EP claimed
EP-3161192-A1 FIBERS WITH MULTICOMPONENT FIBERS USED FOR CODING Eastman Chemical Company (US) 2017-05-03 — — EP claimed
US-9633579-B2 Fibers with physical features used for coding EASTMAN CHEMICAL COMPANY (US) 2017-04-25 — — US claimed
CN-106460237-A Fibers having physical properties for encoding 伊士曼化工公司 2017-02-22 — — CN claimed
US-20150377792-A1 FIBERS WITH MULTICOMPONENT FIBERS USED FOR CODING EASTMAN CHEMICAL COMPANY (US) 2015-12-31 — — US claimed
US-20150379312-A1 FIBERS WITH PHYSICAL FEATURES USED FOR CODING EASTMAN CHEMICAL COMPANY (US) 2015-12-31 — — US claimed
US-20150377841-A1 FIBERS WITH CHEMICAL MARKERS AND PHYSICAL FEATURES USED FOR CODING EASTMAN CHEMICAL COMPANY (US) 2015-12-31 — — US claimed
WO-2015200574-A1 FIBERS WITH MULTICOMPONENT FIBERS USED FOR CODING EASTMAN CHEMICAL COMPANY (US) 2015-12-30 — — WO claimed
WO-2015200572-A1 FIBERS WITH PHYSICAL FEATURES USED FOR CODING EASTMAN CHEMICAL COMPANY (US) 2015-12-30 — — WO claimed
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