SCHEMBL1205488

SCHEMBL1205488

CCCCCN(C#N)C(=N)N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 1/20 0.39
SPHK1 Q9NYA1 1/20 0.39
DNM1 Q05193 3/20 0.33
ZDHHC20 Q5W0Z9 2/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL8070978 0.98 SPHK2 (0.38) SPHK2SPHK1DNM1ZDHHC20ZDHHC2
SCHEMBL1937656 0.98 SPHK2 (0.42) SPHK2SPHK1DNM1ZDHHC20ZDHHC2
SCHEMBL4465867 0.98 SPHK2 (0.42) SPHK2SPHK1DNM1ZDHHC20ZDHHC2
SCHEMBL1937313 0.98 SPHK2 (0.42) SPHK2SPHK1DNM1ZDHHC20ZDHHC2
SCHEMBL1938682 0.98 SPHK2 (0.42) SPHK2SPHK1DNM1ZDHHC20ZDHHC2
SCHEMBL1937984 0.98 SPHK2 (0.42) SPHK2SPHK1DNM1ZDHHC20ZDHHC2
SCHEMBL20361795 0.94 GRIN2D (0.37) SPHK2SPHK1NOS3NOS1NOS2
SCHEMBL9235649 0.87
SCHEMBL1505132 0.87
SCHEMBL19371464 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539099-A4 REVERSED LIQUID CRYSTALLINE PHASES WITH NON-PARAFFIN HYDROPHOBES LYOTROPIC THERAPEUTICS LLC (US) 2009-03-18 EP claimed
EP-1539099-A2 REVERSED LIQUID CRYSTALLINE PHASES WITH NON-PARAFFIN HYDROPHOBES Lyotropic Therapeutics, LLC (US) 2005-06-15 EP claimed
US-20040022820-A1 Reversed liquid crystalline phases with non-paraffin hydrophobes LYOTROPIC THERAPEUTICS, INC. 2004-02-05 US claimed
WO-2003106382-A2 REVERSED LIQUID CRYSTALLINE PHASES WITH NON-PARAFFIN HYDROPHOBES LYOTROPIC THERAPEUTICS, INC. (US) 2003-12-24 WO claimed
US-20020102280-A1 Solvent systems for pharmaceutical agents LYOTROPIC THERAPEUTICS, INC. 2002-08-01 US claimed
EP-3230274-B1 NOVEL ARYL-CYANOGUANIDINE COMPOUNDS Bayer Pharma AG (DE) 2019-01-30 EP disclosed
US-10023539-B2 Aryl-cyanoguanidine compounds BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-07-17 US disclosed
EP-3283480-A1 NOVEL ARYL-CYANOGUANIDINE COMPOUNDS Bayer Pharma Aktiengesellschaft (DE) 2018-02-21 EP disclosed
EP-3283478-A1 NOVEL ARYL-CYANOGUANIDINE COMPOUNDS Bayer Pharma Aktiengesellschaft (DE) 2018-02-21 EP disclosed
EP-3230274-A1 NOVEL ARYL-CYANOGUANIDINE COMPOUNDS Bayer Pharma Aktiengesellschaft (DE) 2017-10-18 EP disclosed
CN-107207442-A Novel aryl-cyanoguanidine compounds 拜耳医药股份有限公司 2017-09-26 CN disclosed
WO-2016166186-A1 NOVEL ARYL-CYANOGUANIDINE COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-10-20 WO disclosed
US-4265905-A FOR AUTOIMMUNE DISEASES MERCK & CO., INC. (US) 1981-05-05 US disclosed
US-4265905-A FOR AUTOIMMUNE DISEASES MERCK & CO., INC. (US) 1981-05-05 US disclosed
US-4202903-A Acyl cyanoguanidines for treating rheumatoid arthritis MERCK & CO., INC. (US) 1980-05-13 US disclosed
US-4202903-A Acyl cyanoguanidines for treating rheumatoid arthritis MERCK & CO., INC. (US) 1980-05-13 US disclosed
US-4202903-A Acyl cyanoguanidines for treating rheumatoid arthritis MERCK & CO., INC. (US) 1980-05-13 US disclosed
US-4057642-A ANTIINFLAMMATORY, RHEUMATOID ARTHRITIS MERCK & CO., INC. (US) 1977-11-08 US disclosed
US-4057642-A ANTIINFLAMMATORY, RHEUMATOID ARTHRITIS MERCK & CO., INC. (US) 1977-11-08 US disclosed
US-4057642-A ANTIINFLAMMATORY, RHEUMATOID ARTHRITIS MERCK & CO., INC. (US) 1977-11-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10023539-B2 Aryl-cyanoguanidine compounds SMYD2, SETD2, SMYD3 SPHK2 620/4885SPHK1 918/4885DNM1 4176/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.