SCHEMBL21031212

SCHEMBL21031212

CCc1cnc(OC(F)F)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 4/20 0.44
HCRTR2 O43614 4/20 0.44
RXRA P19793 6/20 0.40
GRIN1 Q05586 6/20 0.40
GRIN2B Q13224 6/20 0.40
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SCN9A Q15858 3/20 0.32
KCNH2 Q12809 1/20 0.32
RORC P51449 2/20 0.32
LMNA P02545 1/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
APEX1 P27695 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CRHR1 P34998 1/20 0.32

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
SCHEMBL15599161 0.85 S1PR1 (0.40) HCRTR1HCRTR2SCN9ARORC
SCHEMBL4542726 0.83 HCRTR1 (0.42) HCRTR1HCRTR2RXRAGRIN1GRIN2B
SCHEMBL10332075 0.79 SMN1; SMN2 (0.39) HCRTR1HCRTR2PDE4APDE4BPDE4C
SCHEMBL15599228 0.77 GAA (0.37) HCRTR1HCRTR2RXRAGRIN1GRIN2B
SCHEMBL15599257 0.77 MAPK1 (0.43) SCN9ASMN1; SMN2
SCHEMBL15599250 0.77 SCN9A (0.43) SCN9ACYP2C9
SCHEMBL15599248 0.77 CSNK2A1 (0.34) RXRAGRIN1GRIN2BPDE4APDE4B
SCHEMBL18400155 0.76 PTGS2 (0.36) RXRAGRIN1GRIN2BPDE4APDE4B
SCHEMBL19446232 0.75 PTGS2 (0.38) HCRTR1HCRTR2RXRAGRIN1GRIN2B
SCHEMBL15599157 0.75 SMN1; SMN2 (0.39) SCN9ALMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190275012-A9 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS LUPIN LIMITED (IN) 2019-09-12 US disclosed
US-20190160045-A1 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS LUPIN LTD (IN) 2019-05-30 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-20190275012-A9 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS MALT1, PTP4A1, PTPRO HCRTR1 4327/4885HCRTR2 4796/4885RXRA 2984/4885
US-20190160045-A1 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS MALT1, PTP4A1, PTPRO HCRTR1 4327/4885HCRTR2 4796/4885RXRA 2984/4885

“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.