SCHEMBL13708151

SCHEMBL13708151

O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=O)c2cc3cnc4[nH]ccc4c3s2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
LCK P06239 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
POLB P06746 1/20 0.50
ESR1 P03372 1/20 0.50
TSHR P16473 1/20 0.48
PIKFYVE Q9Y2I7 1/20 0.47
KDM4E B2RXH2 1/20 0.47
MDM2 Q00987 1/20 0.47
HKDC1 Q2TB90 1/20 0.47
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 1/20 0.47
AURKA O14965 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
KCNK3 O14649 1/20 0.47
CDK8 P49336 2/20 0.47
TEK Q02763 1/20 0.46
KCNQ3 O43525 1/20 0.46
KCNQ2 O43526 1/20 0.46

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
SCHEMBL13708162 0.96 ESR1 (0.52) MAPTLCKMEN1KMT2APOLB
SCHEMBL13708164 0.90 LCK (0.58) MAPTLCKPOLBPIKFYVEKDM4E
SCHEMBL13708193 0.89 MAPT (0.64) MAPTPOLBKDM4EMDM2HKDC1
SCHEMBL13708163 0.88 CSF1R (0.59) PIKFYVEBRAF
SCHEMBL13708185 0.87 MAPT (0.53) MAPTLCKPOLBESR1PIKFYVE
SCHEMBL13708177 0.86 ESR1 (0.43) MAPTLCKMEN1KMT2APOLB
SCHEMBL13711491 0.85 MAP3K20 (0.42) MAPTKDM4EAURKARXFP1BTK
SCHEMBL13711494 0.84 MAP3K20 (0.42) MAPTKDM4EAURKARXFP1BTK
SCHEMBL13708180 0.84 KCNK3 (0.52) MAPTLCKMEN1KMT2ATSHR
SCHEMBL4463894 0.81 MAPT (0.58) MAPTMEN1KMT2APOLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7589101-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2009-09-15 US disclosed
US-7589101-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2009-09-15 US disclosed
US-20080287432-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-11-20 US disclosed
US-20080287432-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-11-20 US disclosed
WO-2007022268-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2007-02-22 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-20080287432-A1 Compounds and Compositions as Protein Kinase Inhibitors AURKC, PTK2B, FRK MAPT 1523/4885LCK 32/4885MEN1 3414/4885

“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.