SCHEMBL24236754

SCHEMBL24236754

C=C(Cl)C[C@@](C)(Cc1ccccc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.46
CYP2C9 P11712 2/20 0.46
CYP3A4 P08684 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HIF1A Q16665 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PPARG P37231 2/20 0.43
PPARA Q07869 2/20 0.43
PPARD Q03181 1/20 0.40
SLC6A2 P23975 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
CYP1A2 P05177 2/20 0.39
MMP8 P22894 4/20 0.38
LMNA P02545 1/20 0.38
CYP2D6 P10635 1/20 0.38
RECQL P46063 1/20 0.38
TRPA1 O75762 1/20 0.38
MAPK1 P28482 1/20 0.37
BLM P54132 1/20 0.37
FDPS P14324 1/20 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
SCHEMBL24236757 1.00 CYP2C19 (0.46) CYP2C19CYP2C9CYP3A4ALDH1A1HIF1A
SCHEMBL24236743 1.00 CYP2C19 (0.46) CYP2C19CYP2C9CYP3A4ALDH1A1HIF1A
SCHEMBL24236689 0.90 CYP2C19 (0.46) CYP2C19CYP2C9CYP3A4ALDH1A1HIF1A
SCHEMBL24236686 0.90 CYP2C19 (0.46) CYP2C19CYP2C9CYP3A4ALDH1A1HIF1A
SCHEMBL21835010 0.85 ALDH1A1 (0.47) CYP2C19CYP2C9CYP3A4ALDH1A1HIF1A
SCHEMBL21834964 0.85 ALDH1A1 (0.47) CYP2C19CYP2C9CYP3A4ALDH1A1HIF1A
SCHEMBL7256038 0.82 HIF1A (0.56) CYP2C19CYP2C9CYP3A4ALDH1A1HIF1A
SCHEMBL7415791 0.82 HIF1A (0.56) CYP2C19CYP2C9CYP3A4ALDH1A1HIF1A
SCHEMBL27908890 0.82 SMN1; SMN2 (0.57) CYP2C19CYP2C9CYP3A4ALDH1A1HIF1A
SCHEMBL24236685 0.79 ALDH1A1 (0.45) CYP2C19CYP2C9CYP3A4ALDH1A1HIF1A

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-20220030867-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2022-02-03 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-20220030867-A1 FUNGICIDAL COMPOSITIONS CYP1B1, CYP4B1, CYP3A43 CYP2C19 4/4885CYP2C9 14/4885CYP3A4 23/4885

“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.