SCHEMBL22145308

SCHEMBL22145308

C[C@@H](O)Cc1ccc(Cl)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 2/20 0.46
PPARG P37231 2/20 0.40
PPARA Q07869 1/20 0.40
MAPK1 P28482 4/20 0.40
MAPT P10636 2/20 0.40
KCNH2 Q12809 1/20 0.36
ALOX15 P16050 3/20 0.36
ALOX12 P18054 3/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
ESR1 P03372 2/20 0.36
TP53 P04637 2/20 0.36
CYP3A4 P08684 2/20 0.36
HPGD P15428 2/20 0.36
RECQL P46063 2/20 0.36
KMT2A Q03164 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 2/20 0.36
LMNA P02545 2/20 0.36

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
SCHEMBL22122818 1.00 PNMT (0.46) PNMTPPARGPPARAMAPK1MAPT
SCHEMBL22122819 1.00 PNMT (0.46) PNMTPPARGPPARAMAPK1MAPT
SCHEMBL28747785 0.85 PNMT (0.46) PNMTKCNH2KDM4EMEN1CYP3A4
SCHEMBL530213 0.85 PNMT (0.48) PNMTPPARGPPARAMAPK1MAPT
SCHEMBL2424621 0.82 PNMT (0.66) PNMTALOX15POLBSLC6A2SLC6A3
SCHEMBL8469433 0.82 ALOX15 (0.39) PPARGMAPK1MAPTALOX15ALOX12
SCHEMBL19404310 0.82 ALOX15 (0.39) PPARGMAPK1MAPTALOX15ALOX12
SCHEMBL22122724 0.81 PNMT (0.46) PNMTPPARGPPARAMAPK1MAPT
SCHEMBL16649712 0.81 PNMT (0.70) PNMTSLC6A2HTR2AHTR2BSLC6A3
SCHEMBL24568964 0.80 PNMT (0.44) PNMTPPARGPPARAMAPK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220144848-A1 SUBSTITUTED OXOPYRIDINE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2022-05-12 US disclosed
US-20220144848-A1 SUBSTITUTED OXOPYRIDINE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2022-05-12 US disclosed
WO-2020127508-A1 SUBSTITUTED OXOPYRIDINE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2020-06-25 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-20220144848-A1 SUBSTITUTED OXOPYRIDINE DERIVATIVES MVD, VASP, SELP PNMT 648/4885PPARG 876/4885PPARA 866/4885

“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.