SCHEMBL2953479

SCHEMBL2953479

Cc1cc(OCCCNC(=O)c2ccncc2)ccc1Nc1nc(NC2CCCCC2)c2nc[nH]c2n1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 3/20 0.47
AXL P30530 1/20 0.47
TTK P33981 9/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ADORA3 P0DMS8 1/20 0.37
ADORA1 P30542 1/20 0.37
BRD4 O60885 1/20 0.37
CLK1 P49759 1/20 0.36
CLK2 P49760 1/20 0.36
TYRO3 Q06418 4/20 0.36
GAS6 Q14393 2/20 0.36
TSHR P16473 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
FLT3 P36888 1/20 0.35
SELP P16109 1/20 0.35

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
SCHEMBL2949092 0.98 MERTK (0.46) MERTKAXLTTKMEN1KMT2A
SCHEMBL2946205 0.93 MERTK (0.48) MERTKAXLTTKADORA3ADORA1
SCHEMBL3037506 0.89 MERTK (0.46) MERTKAXLTTKADORA3ADORA1
SCHEMBL2950079 0.88 MERTK (0.50) MERTKAXLTTKADORA3ADORA1
SCHEMBL2951204 0.87 AXL (0.47) MERTKAXLTTKADORA3ADORA1
SCHEMBL2956364 0.86 AXL (0.49) MERTKAXLTTKADORA3ADORA1
SCHEMBL3698227 0.86 AXL (0.47) MERTKAXLTTKMEN1KMT2A
SCHEMBL4766705 0.85 AXL (0.45) MERTKAXLTTKADORA3ADORA1
SCHEMBL2954639 0.85 AXL (0.46) MERTKAXLTTKADORA3ADORA1
SCHEMBL4766652 0.85 AXL (0.45) MERTKAXLTTKADORA3ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010111406-A2 COMPOUNDS AND THERAPEUTIC USES THEREOF MYRIAD PHARMACEUTICALS, INC. (US) 2010-09-30 WO claimed
US-20120122840-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF MYREXIS, INC. (US) 2012-05-17 US disclosed
US-20120122840-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF MYREXIS, INC. (US) 2012-05-17 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-20120122840-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF VHL, TP53, ASAH2 MERTK 1662/4885AXL 2976/4885TTK 4589/4885

“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.