SCHEMBL980293

SCHEMBL980293

CC(=O)OC(C)(c1cn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c2cccnc12)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 5/20 0.37
MAPT P10636 3/20 0.36
HPGD P15428 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
HTT P42858 1/20 0.36
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
KDM4E B2RXH2 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
HSP90AA1 P07900 1/20 0.36
GABRA2 P47869 1/20 0.35
GABRB2 P47870 1/20 0.35
GRIN2B Q13224 1/20 0.34
PTPN6 P29350 1/20 0.34
PTPN11 Q06124 1/20 0.34
TACR1 P25103 1/20 0.34
TRPA1 O75762 1/20 0.34
TRPV1 Q8NER1 1/20 0.34

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
SCHEMBL2830711 0.85 HPGD (0.44) RORCMAPTHPGDNPSR1HTT
SCHEMBL980587 0.82 GABRA2 (0.40) RORCMAPTHPGDNPSR1HTT
SCHEMBL982286 0.74 GABRA2 (0.39) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL2829556 0.74 RORC (0.37) RORCMAPTHPGDALDH1A1TDP1
SCHEMBL2828899 0.71 HPGD (0.43) RORCMAPTHPGDNPSR1HTT
SCHEMBL2834112 0.70 GABRA2 (0.43) MAPTHPGDNPSR1HTTALDH1A1
SCHEMBL2831134 0.69 HPGD (0.41) MAPTHPGDNPSR1HTTALDH1A1
SCHEMBL2828429 0.68 GABRA2 (0.45) RORCMAPTHPGDNPSR1HTT
SCHEMBL4415348 0.68 GABRA2 (0.40) RORCL3MBTL1GABRA2GABRB2CYP3A4
SCHEMBL2829188 0.65 MAPT (0.42) RORCMAPTHPGDNPSR1HTT

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-20110021543-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS PESTICIDES NOVARTIS AG (CH) 2011-01-27 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-20110021543-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS PESTICIDES DDT, TYR, CAT RORC 2101/4885MAPT 2897/4885HPGD 721/4885

“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.