SCHEMBL23926189

SCHEMBL23926189

CCC(=O)N[C@H](C)COc1ncc(C(F)(F)F)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
MAPK1 P28482 1/20 0.47
PKM P14618 2/20 0.47
MRGPRX4 Q96LA9 1/20 0.46
SCN9A Q15858 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
FFAR1 O14842 1/20 0.45
PPARG P37231 1/20 0.44

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
SCHEMBL22798278 0.83 SCN9A (0.61) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL22798280 0.83 SCN9A (0.61) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL20595160 0.82 SCN9A (0.62) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL20595161 0.82 SCN9A (0.62) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL28354862 0.81 SMN1; SMN2 (0.50) ALDH1A1KMT2AKDM4ELMNASMN1; SMN2
SCHEMBL15731331 0.80 SCN9A (0.47) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL8771848 0.78 KDM4E (0.44) ALDH1A1KMT2AKDM4ELMNASMN1; SMN2
SCHEMBL13046537 0.77 LMNA (0.42) ALDH1A1KMT2AKDM4ELMNASMN1; SMN2
SCHEMBL28354400 0.76 SMN1; SMN2 (0.49) ALDH1A1KMT2AKDM4ELMNASMN1; SMN2
SCHEMBL22798207 0.76 SCN9A (0.63) ALDH1A1KMT2AKDM4ELMNASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11154544-B2 Amide derivatives as Nav1.7 and Nav1.8 blockers RAQUALIA PHARMA INC. (JP) 2021-10-26 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-11154544-B2 Amide derivatives as Nav1.7 and Nav1.8 blockers SCN8A, SCN7A, SCN1A ALDH1A1 2581/4885KMT2A 1799/4885MEN1 3745/4885

“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.