SCHEMBL16146689

SCHEMBL16146689

Cc1cccc(Nc2cc(N[C@@H]3CCCC[C@H]3N)ncc2C(N)=O)n1

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 17/20 0.77
▸ KCNH2 Q12809 11/20 0.71
▸ JAK2 O60674 2/20 0.56
▸ JAK1 P23458 2/20 0.56
▸ TYK2 P29597 2/20 0.56
▸ JAK3 P52333 2/20 0.56
▸ MAP4K4 O95819 1/20 0.56
▸ GSK3B P49841 1/20 0.56
▸ MAPK3 P27361 2/20 0.54
▸ MAPK1 P28482 2/20 0.54
▸ AURKB Q96GD4 2/20 0.54
▸ GP6 Q9HCN6 1/20 0.54
▸ FER P16591 1/20 0.53
▸ ZAP70 P43403 1/20 0.53

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
SCHEMBL14842037 1.00 SYK (0.77) SYKKCNH2JAK2JAK1TYK2
SCHEMBL14842025 0.87 SYK (1.00) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL17745676 0.87 SYK (0.64) SYKKCNH2JAK3MAPK3MAPK1
SCHEMBL14842284 0.86 SYK (0.71) SYKKCNH2JAK2MAP4K4MAPK3
SCHEMBL14852895 0.86 SYK (0.71) SYKKCNH2JAK2MAP4K4MAPK3
SCHEMBL16153729 0.86 SYK (0.71) SYKKCNH2JAK2MAP4K4MAPK3
SCHEMBL14852985 0.85 SYK (1.00) SYKKCNH2JAK2MAP4K4MAPK3
SCHEMBL14842576 0.85 SYK (1.00) SYKKCNH2JAK2MAP4K4MAPK3
SCHEMBL14842069 0.85 SYK (0.72) SYKKCNH2JAK2ZAP70
SCHEMBL14842105 0.85 SYK (0.72) SYKKCNH2MAPK3MAPK1AURKB

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
EP-2763975-B1 3-PYRIDYL CARBOXAMIDE-CONTAINING SPLEEN TYROSINE KINASE (SYK) INHIBITORS MERCK SHARP & DOHME (US) 2016-04-06 — — EP claimed
US-8987456-B2 3-pyridyl carboxamide-containing spleen tyrosine kinase (SYK) inhibitors MERCK SHARP & DOHME CORP. (US) 2015-03-24 — — US claimed
US-20140303206-A1 3-Pyridyl Carboxamide-Containing Spleen Tyrosine Kinase (SYK) Inhibitors MERCK SHARP & DOHME LLC 2014-10-09 — — US claimed
EP-2763975-B1 3-PYRIDYL CARBOXAMIDE-CONTAINING SPLEEN TYROSINE KINASE (SYK) INHIBITORS MERCK SHARP & DOHME (US) 2016-04-06 — — EP disclosed
US-8987456-B2 3-pyridyl carboxamide-containing spleen tyrosine kinase (SYK) inhibitors MERCK SHARP & DOHME CORP. (US) 2015-03-24 — — US disclosed
US-20140303206-A1 3-Pyridyl Carboxamide-Containing Spleen Tyrosine Kinase (SYK) Inhibitors MERCK SHARP & DOHME LLC 2014-10-09 — — 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-20140303206-A1 3-Pyridyl Carboxamide-Containing Spleen Tyrosine Kinase (SYK) Inhibitors SYK, BTK, LCK SYK 1/4885KCNH2 2114/4885JAK2 14/4885

“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.

Send feedback