SCHEMBL26759263

SCHEMBL26759263

CC/C(Cl)=C/c1cc(N2C(=O)C3=C(CCCC3)C2=O)ccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPOX P50336 1/20 0.40
BCL2A1 Q16548 4/20 0.37
MAPT P10636 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
BCL2 P10415 1/20 0.34
ALOX12 P18054 1/20 0.34
BID P55957 1/20 0.34
RAD51 Q06609 1/20 0.34
BCL2L1 Q07817 1/20 0.34
BCL2L2 Q92843 1/20 0.34

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
SCHEMBL24293381 0.88 PPOX (0.40) PPOXBCL2A1MAPTKMT2AALDH1A1
SCHEMBL24293385 0.85 PPOX (0.38) PPOXBCL2A1MAPTKMT2AALDH1A1
SCHEMBL7961485 0.85 PPOX (0.38) PPOXBCL2A1MAPTKMT2A
SCHEMBL7961482 0.85 PPOX (0.38) PPOXBCL2A1MAPTKMT2A
SCHEMBL5467830 0.84 MAPT (0.37) PPOXMAPTKMT2AALDH1A1
SCHEMBL39177 0.84 MAPT (0.37) PPOXMAPTKMT2AALDH1A1
SCHEMBL3676781 0.84 PPOX (0.39) PPOX
SCHEMBL3676777 0.84 PPOX (0.39) PPOX
SCHEMBL7164157 0.83 PPOX (0.34) PPOXBCL2A1MAPT
SCHEMBL7894541 0.83 PPOX (0.34) PPOXBCL2A1MAPT

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-20230365493-A1 COMPOUNDS AND METHODS DemAgtech Pty Ltd (AU) 2023-11-16 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-20230365493-A1 COMPOUNDS AND METHODS DDT, CYP19A1, CYP1A1 PPOX 464/4885BCL2A1 225/4885MAPT 3708/4885

“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.