SCHEMBL22303136

SCHEMBL22303136

CCSc1c(Cl)nc2ccc(C(F)(F)F)cn12

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 8/20 0.46
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
USP7 Q93009 1/20 0.39
SLC2A1 P11166 1/20 0.38
KDM4E B2RXH2 4/20 0.37
HSD17B10 Q99714 1/20 0.37
RXFP1 Q9HBX9 3/20 0.36
GABRD O14764 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRA4 P48169 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NR1H4 Q96RI1 1/20 0.34
MCHR1 Q99705 1/20 0.33

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
SCHEMBL23131664 0.83 TRPA1 (0.41) TRPA1ALDH1A1SMN1; SMN2USP7SLC2A1
SCHEMBL22519297 0.83 USP7 (0.50) TRPA1ALDH1A1SMN1; SMN2USP7SLC2A1
SCHEMBL19712037 0.81 TRPA1 (0.40) TRPA1ALDH1A1SMN1; SMN2USP7SLC2A1
SCHEMBL19992574 0.80 TRPA1 (0.44) TRPA1ALDH1A1SMN1; SMN2USP7SLC2A1
SCHEMBL23387940 0.79 TRPA1 (0.39) TRPA1ALDH1A1SMN1; SMN2USP7SLC2A1
SCHEMBL19711945 0.79 TRPA1 (0.39) TRPA1ALDH1A1SMN1; SMN2USP7SLC2A1
SCHEMBL19992536 0.79 TRPA1 (0.44) TRPA1ALDH1A1SMN1; SMN2USP7SLC2A1
SCHEMBL22519225 0.78 PSD (0.40) TRPA1ALDH1A1SMN1; SMN2SLC2A1RXFP1
Hydrochloric Acid SCHEMBL19712038 0.78 TRPA1 (0.38) TRPA1ALDH1A1SMN1; SMN2USP7SLC2A1
SCHEMBL19711954 0.78 USP7 (0.40) TRPA1ALDH1A1SMN1; SMN2USP7KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220217979-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD PEST CONTROL COMPOSITION CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2022-07-14 US disclosed
EP-3928607-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD-CONTROLLING COMPOSITION CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-12-29 EP disclosed
US-20210380610-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD-CONTROLLING COMPOSITION CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-12-09 US disclosed
EP-3918896-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD CONTROL COMPOSITION CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-12-08 EP disclosed
WO-2021141106-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD-CONTROLLING COMPOSITION INCLUDING SAME 住友化学株式会社 2021-07-15 WO disclosed
WO-2020203763-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD PEST CONTROL COMPOSITION CONTAINING SAME 住友化学株式会社 2020-10-08 WO disclosed
WO-2020158889-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD CONTROL COMPOSITION CONTAINING SAME 住友化学株式会社 2020-08-06 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 (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-20210380610-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD-CONTROLLING COMPOSITION CONTAINING SAME C5, COX6C, C3AR1 TRPA1 735/4885ALDH1A1 878/4885SMN1; SMN2 2000/4885
US-20220217979-A1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD PEST CONTROL COMPOSITION CONTAINING SAME C5, COX6C, C1S TRPA1 475/4885ALDH1A1 1268/4885SMN1; SMN2 2054/4885

“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.