SCHEMBL14235481

SCHEMBL14235481

Cc1nc(Cl)c2occc2n1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 2/20 0.33
HTT P42858 1/20 0.33
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
CYP2A6 P11509 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL190033 0.79 TDP1 (0.31) TDP1ALDH1A1
SCHEMBL14213484 0.79 CYP2A6 (0.33) LMNAHTTPDE4APDE4BPDE4C
SCHEMBL19661009 0.76 LMNA (0.30) LMNAHTT
SCHEMBL20618325 0.73
SCHEMBL19523129 0.73
SCHEMBL7607941 0.72 KDM4E (0.35) LMNACYP2A6ALDH1A1
SCHEMBL1653524 0.72 TDP1 (0.43) TDP1LMNAPDE4APDE4BPDE4C
SCHEMBL1369046 0.68 PDE4A (0.43) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL856788 0.68 TDP1 (0.54) TDP1LMNAHTTPDE4APDE4B
SCHEMBL29461212 0.68 TDP1 (0.54) TDP1LMNAHTTPDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120309773-A1 HETEROCYCLIC COMPOUNDS AS JANUS KINASE INHIBITORS BIOCRYST PHARMACEUTICALS, INC. 2012-12-06 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-20120309773-A1 HETEROCYCLIC COMPOUNDS AS JANUS KINASE INHIBITORS JAK2, JAK1, JAK3 TDP1 2594/4885LMNA 4661/4885HTT 3739/4885

“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.