SCHEMBL17673557

SCHEMBL17673557

Cn1nc(CCCCO)c2ccc(Br)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 1/20 0.37
▸ CDK5 Q00535 1/20 0.37
▸ TYRO3 Q06418 1/20 0.37
▸ MAPK8 P45983 2/20 0.33
▸ CYP11B1 P15538 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ ESR1 P03372 1/20 0.33
▸ NLRP3 Q96P20 1/20 0.32
▸ EGLN1 Q9GZT9 2/20 0.32
▸ LSS P48449 1/20 0.31
▸ CSNK2A2 P19784 1/20 0.31
▸ CSNK2B P67870 1/20 0.31
▸ CSNK2A1 P68400 1/20 0.31
▸ CSNK2A3 Q8NEV1 1/20 0.31
▸ ADORA2A P29274 1/20 0.31
▸ ADORA2B P29275 1/20 0.31
▸ MCL1 Q07820 1/20 0.31
▸ BACE1 P56817 1/20 0.30
▸ SCN5A Q14524 1/20 0.30
▸ SCN9A Q15858 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
SCHEMBL17673736 0.96 PDGFRA (0.38) PDGFRACDK5TYRO3MAPK8CYP11B1
SCHEMBL17673889 0.90 PDGFRA (0.39) PDGFRACDK5TYRO3MAPK8ESR1
SCHEMBL20520453 0.83 PDGFRA (0.41) PDGFRACDK5TYRO3MAPK8ESR1
SCHEMBL30258317 0.83 PDGFRA (0.41) PDGFRACDK5TYRO3MAPK8ESR1
SCHEMBL4507507 0.79 GRM4 (0.43) PDGFRACDK5TYRO3MAPK8ESR1
SCHEMBL31068115 0.79 PDGFRA (0.39) PDGFRACDK5TYRO3MAPK8ESR1
SCHEMBL29349067 0.79 PDGFRA (0.39) PDGFRACDK5TYRO3MAPK8ESR1
SCHEMBL20520398 0.77 PDGFRA (0.38) PDGFRACDK5TYRO3MAPK8ESR1
SCHEMBL30258108 0.77 PDGFRA (0.38) PDGFRACDK5TYRO3MAPK8ESR1
SCHEMBL17674049 0.77 KDM4E (0.33) PDGFRACDK5TYRO3MAPK8LSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190151312-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2019-05-23 — — US disclosed
EP-3204009-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BioMarin Pharmaceutical Inc. (US) 2017-08-16 — — EP disclosed
WO-2016057834-A9 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2017-04-13 — — WO disclosed
WO-2016057834-A9 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2017-04-13 — — WO disclosed
WO-2016057834-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2016-04-14 — — WO disclosed
WO-2016057834-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2016-04-14 — — WO 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-20190151312-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES HPSE, GAA, MAN2B1 PDGFRA 1791/4885CDK5 2751/4885TYRO3 2385/4885

“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.

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