SCHEMBL16435496

SCHEMBL16435496

CCCCNc1ncc(C(=O)NC2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)c(N[C@H]2CC[C@H](O)CC2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MERTK Q12866 19/20 1.00
▸ FLT3 P36888 18/20 1.00
▸ TYRO3 Q06418 18/20 1.00
▸ GAS6 Q14393 16/20 1.00
▸ AXL P30530 6/20 0.77

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
SCHEMBL16435466 0.89 FLT3 (1.00) MERTKFLT3TYRO3GAS6AXL
SCHEMBL16435507 0.88 MERTK (1.00) MERTKFLT3TYRO3GAS6AXL
SCHEMBL16438297 0.87 MERTK (1.00) MERTKFLT3TYRO3GAS6AXL
SCHEMBL16435508 0.87 MERTK (1.00) MERTKFLT3TYRO3GAS6AXL
SCHEMBL16435476 0.87 MERTK (1.00) MERTKFLT3TYRO3GAS6AXL
SCHEMBL16438336 0.87 MERTK (1.00) MERTKFLT3TYRO3GAS6AXL
SCHEMBL16435472 0.86 MERTK (1.00) MERTKFLT3TYRO3GAS6AXL
SCHEMBL16438335 0.86 MERTK (1.00) MERTKFLT3TYRO3GAS6AXL
SCHEMBL16435515 0.84 FLT3 (1.00) MERTKFLT3TYRO3GAS6AXL
SCHEMBL17169896 0.84 MERTK (1.00) MERTKFLT3TYRO3GAS6AXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9649309-B2 Therapeutic uses of selected pyrimidine compounds with anti-Mer tyrosine kinase activity THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2017-05-16 — — US disclosed
US-9649309-B2 Therapeutic uses of selected pyrimidine compounds with anti-Mer tyrosine kinase activity THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2017-05-16 — — US disclosed
US-9567326-B2 Pyrimidine compounds for the treatment of cancer THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2017-02-14 — — US disclosed
US-9567326-B2 Pyrimidine compounds for the treatment of cancer THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2017-02-14 — — US disclosed
US-20150290194-A1 THERAPEUTIC USES OF SELECTED PYRIMIDINE COMPOUNDS WITH ANTI-MER TYROSINE KINASE ACTIVITY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-10-15 — — US disclosed
US-20150290194-A1 THERAPEUTIC USES OF SELECTED PYRIMIDINE COMPOUNDS WITH ANTI-MER TYROSINE KINASE ACTIVITY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-10-15 — — US disclosed
US-20150038481-A1 PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF CANCER NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-02-05 — — US disclosed
US-20150038481-A1 PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF CANCER NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-02-05 — — 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 (2 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-20150290194-A1 THERAPEUTIC USES OF SELECTED PYRIMIDINE COMPOUNDS WITH ANTI-MER TYROSINE KINASE ACTIVITY MERTK, FLT3, TK1 MERTK 1/4885FLT3 2/4885TYRO3 41/4885
US-20150038481-A1 PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF CANCER DPYD, TYMP, TYMS MERTK 2234/4885FLT3 30/4885TYRO3 845/4885

“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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