SCHEMBL25968636

SCHEMBL25968636

COc1cnn(Cc2nc(CCc3ccc(Cl)cc3)no2)c(=O)c1Cl

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 12/20 0.53
MAPT P10636 3/20 0.43
TSHR P16473 1/20 0.43
NPBWR1 P48145 1/20 0.43
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL25969977 0.88 TRPA1 (0.53) TRPA1MAPTTSHRNPBWR1RAB9A
SCHEMBL25974095 0.86 TRPA1 (0.55) TRPA1MAPTRAB9ASMN1; SMN2MEN1
SCHEMBL25969531 0.86 TRPA1 (0.52) TRPA1MAPTTSHRNPBWR1RAB9A
SCHEMBL25969533 0.85 TRPA1 (0.47) TRPA1MEN1KMT2A
SCHEMBL25970867 0.84 TRPA1 (0.53) TRPA1MAPTRAB9AMEN1NPC1
SCHEMBL25969838 0.84 TRPA1 (0.53) TRPA1MAPTRAB9ASMN1; SMN2MEN1
SCHEMBL25969660 0.84 TRPA1 (0.53) TRPA1MAPTRAB9AMEN1NPC1
SCHEMBL25969052 0.84 TRPA1 (0.53) TRPA1MAPTNPBWR1RAB9ASMN1; SMN2
SCHEMBL25969149 0.82 TRPA1 (0.52) TRPA1MAPTRAB9AMEN1NPC1
SCHEMBL25969154 0.82 TRPA1 (0.52) TRPA1MAPTRAB9ASMN1; SMN2MEN1

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-20250154139-A1 PYRIDAZINONE COMPOUNDS AS TRPA1 INHIBITORS D. E. SHAW RESEARCH, LLC 2025-05-15 US disclosed
WO-2023150591-A2 PYRIDAZINONE COMPOUNDS AS TRPA1 INHIBITORS D.E. SHAW RESEARCH, LLC (US) 2023-08-10 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-20250154139-A1 PYRIDAZINONE COMPOUNDS AS TRPA1 INHIBITORS TRPA1, TRPV1, TRPV5 TRPA1 1/4885MAPT 1001/4885TSHR 1935/4885

“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.