SCHEMBL25443271

SCHEMBL25443271

CC(C)c1cc(Cl)c(N)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
CYP3A4 P08684 2/20 0.50
ADRB1 P08588 5/20 0.44
ADRB2 P07550 3/20 0.44
LMNA P02545 2/20 0.44
HTR1A P08908 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
ADRA1A P35348 1/20 0.44
OPRK1 P41145 1/20 0.44
SLC6A3 Q01959 1/20 0.44
TSHR P16473 1/20 0.44
KDM4E B2RXH2 2/20 0.43
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
EIF4A3 P38919 1/20 0.38
GAA P10253 3/20 0.37
ALOX12 P18054 2/20 0.37
HTT P42858 2/20 0.37

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
SCHEMBL4336582 0.82 CYP3A4 (0.48) ALDH1A1CYP3A4ADRB1ADRB2LMNA
SCHEMBL13210667 0.81 ADRB1 (0.38) ALDH1A1CYP3A4ADRB1ADRB2LMNA
SCHEMBL29290531 0.80 ADRB1 (0.50) ALDH1A1CYP3A4ADRB1ADRB2LMNA
SCHEMBL13557880 0.80 ADRB1 (0.34) ALDH1A1CYP3A4ADRB1ADRB2LMNA
SCHEMBL13210655 0.80 ADRB1 (0.34) ALDH1A1CYP3A4ADRB1ADRB2LMNA
SCHEMBL14486799 0.80 ADRB2 (0.56) CYP3A4ADRB1ADRB2LMNAHTR1A
SCHEMBL1595637 0.78 CYP3A4 (0.55) ALDH1A1CYP3A4ADRB1ADRB2LMNA
SCHEMBL11290173 0.78 ALDH1A1 (0.45) ALDH1A1CYP3A4LMNATSHREIF4A3
SCHEMBL12889907 0.78 EIF4A3 (0.40) ALDH1A1LMNASLC6A2SLC6A4SLC6A3
SCHEMBL10346107 0.76 EIF4A3 (0.39) LMNAEIF4A3ALOX12HTTHIF1A

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-20230142739-A1 PROTEIN-PROTEIN INTERACTION STABILIZERS UNIV CALIFORNIA (US) 2023-05-11 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-20230142739-A1 PROTEIN-PROTEIN INTERACTION STABILIZERS HSPBP1, HSPA8, HSPH1 ALDH1A1 3889/4885CYP3A4 4570/4885ADRB1 4480/4885

“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.