SCHEMBL24590303

SCHEMBL24590303

CN(C(=O)c1ccccc1)c1cccc(C(=O)Nc2c(Br)cc(C(F)(C(F)(F)F)C(F)(F)F)cc2OC(F)F)c1F

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 5/20 0.33
SCN8A Q9UQD0 2/20 0.33
SCN10A Q9Y5Y9 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
TSHR P16473 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
SCHEMBL22402095 0.94 HTT (0.36) DHODHSCN8ASCN10ARXFP1SMN1; SMN2
SCHEMBL20846715 0.91 HTT (0.34) DHODHSCN8ASCN10ARXFP1SMN1; SMN2
SCHEMBL1766977 0.90 NR1H3 (0.38) RXFP1SMN1; SMN2MEN1KMT2ANR1H2
SCHEMBL18354046 0.90 TSHR (0.35) DHODHSCN8ASCN10AMEN1KMT2A
SCHEMBL28523238 0.87 CSNK1E (0.33) DHODHSMN1; SMN2MEN1KMT2A
SCHEMBL17067330 0.86 DHODH (0.34) DHODHSCN8ASCN10ARXFP1
SCHEMBL19695906 0.86 SCN8A (0.35) DHODHSCN8ASCN10ARXFP1SMN1; SMN2
SCHEMBL29733643 0.85 MEN1 (0.39) RXFP1SMN1; SMN2MEN1KMT2ANR1H2
SCHEMBL1766891 0.85 MEN1 (0.39) RXFP1SMN1; SMN2MEN1KMT2ANR1H2
SCHEMBL29361693 0.85 MEN1 (0.39) RXFP1SMN1; SMN2MEN1KMT2ANR1H2

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-20220202011-A1 PIPERIC ACID DERIVATIVE AND APPLICATION THEREOF JIANGSU YANGNONG CHEMICAL CO., LTD (CN) 2022-06-30 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 (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-20220202011-A1 PIPERIC ACID DERIVATIVE AND APPLICATION THEREOF ALDH7A1, CAT, PIR DHODH 200/4885SCN8A 2806/4885SCN10A 2206/4885

“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.