SCHEMBL26416220

SCHEMBL26416220

CCCc1ccc(C)c(O/C(=C\OC)C(=O)OC)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 2/20 0.39
ALDH1A1 P00352 1/20 0.39
PKM P14618 1/20 0.38
MAPK1 P28482 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
ALOX5 P09917 1/20 0.37
OR51E2 Q9H255 1/20 0.37
THRB P10828 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NCEH1 Q6PIU2 2/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35

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
SCHEMBL23712445 0.87 CYP4F2 (0.40) SMN1; SMN2ALDH1A1PKMALOX5OR51E2
SCHEMBL26418742 0.86 PKM (0.39) SMN1; SMN2POLBALDH1A1PKMALOX5
SCHEMBL26418791 0.83 PKM (0.34) SMN1; SMN2POLBALDH1A1PKMKMT2A
SCHEMBL26418787 0.83 PKM (0.34) PKMMEN1KMT2AACHE
SCHEMBL26418778 0.82 MPO (0.39) SMN1; SMN2POLBALDH1A1MEN1KMT2A
SCHEMBL8022699 0.81 PTGS1 (0.34) NPC1RAB9ASMN1; SMN2ALDH1A1PKM
SCHEMBL8024513 0.81 PKM (0.33) PKM
SCHEMBL26418809 0.80 ACHE (0.34) PKMACHE
SCHEMBL26418764 0.80 FFAR1 (0.44) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1
SCHEMBL26418733 0.80 APP (0.38) SMN1; SMN2ALDH1A1MEN1KMT2ACYP2C9

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-20230125322-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2023-04-27 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-20230125322-A1 FUNGICIDAL COMPOSITIONS CYP51A1, CYP4X1, CYP1B1 NPC1 2486/4885RAB9A 3970/4885SMN1; SMN2 3972/4885

“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.