SCHEMBL27893120

SCHEMBL27893120

CCC(C)C(N)C(=O)NCCN1CCOCC1.O=S(=O)(O)S(=O)(=O)O

nearest known ligand 0.88

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.53
▸ ALDH1A1 P00352 3/20 0.51
▸ TDP1 Q9NUW8 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MMP3 P08254 2/20 0.42
▸ MMP9 P14780 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ TLR2 O60603 1/20 0.42
▸ MMP1 P03956 1/20 0.41

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
Sulfuric Acid SCHEMBL19837752 0.96 TSHR (0.54) TSHRALDH1A1TDP1SMN1; SMN2MMP3
Sulfuric Acid SCHEMBL1818768 0.96 TSHR (0.54) TSHRALDH1A1TDP1SMN1; SMN2MMP3
Sulfuric Acid SCHEMBL29684494 0.96 TSHR (0.54) TSHRALDH1A1TDP1SMN1; SMN2MMP3
Sulfuric Acid SCHEMBL19900361 0.96 TSHR (0.54) TSHRALDH1A1TDP1SMN1; SMN2MMP3
Sulfuric Acid SCHEMBL1815849 0.96 TSHR (0.54) TSHRALDH1A1TDP1SMN1; SMN2MMP3
SCHEMBL1819631 0.96 TSHR (0.54) TSHRALDH1A1TDP1SMN1; SMN2MMP3
Sulfuric Acid SCHEMBL31198220 0.96 TSHR (0.54) TSHRALDH1A1TDP1SMN1; SMN2MMP3
SCHEMBL1818338 0.96 TSHR (0.54) TSHRALDH1A1TDP1SMN1; SMN2MMP3
SCHEMBL1723696 0.94 TSHR (0.59) TSHRALDH1A1TDP1MMP3MMP9
SCHEMBL1723878 0.94 TSHR (0.59) TSHRALDH1A1TDP1MMP3MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104995180-A Crystalline forms of neurotrophin mimetic compounds and their salts PHARMATROPHIX INC 2015-10-21 — — CN claimed
CN-102740856-B Crystalline forms of neurotrophin mimetic compounds and salts thereof PHARMATROPHIX INC 2015-02-18 — — CN claimed
CN-102740856-A Crystalline forms of neurotrophin mimetic compounds and salts thereof PHARMATROPHIX INC 2012-10-17 — — CN claimed
CN-108383804-A The crystal form of neurotrophin simulated compound and its salt 特罗菲克斯制药股份有限公司 2018-08-10 — — CN disclosed
CN-104761515-B The crystal formation of neurotrophin simulated compound and its salt 特罗菲克斯制药股份有限公司 2018-03-09 — — CN disclosed
CN-104995180-A Crystalline forms of neurotrophin mimetic compounds and their salts PHARMATROPHIX INC 2015-10-21 — — CN disclosed
CN-104761515-A Crystalline forms of neurotrophin mimetic compounds and salts of same PHARMATROPHIX INC 2015-07-08 — — CN disclosed
CN-102740856-B Crystalline forms of neurotrophin mimetic compounds and salts thereof PHARMATROPHIX INC 2015-02-18 — — CN disclosed
CN-102740856-A Crystalline forms of neurotrophin mimetic compounds and salts thereof PHARMATROPHIX INC 2012-10-17 — — CN disclosed
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