SCHEMBL22386552

SCHEMBL22386552

COCCOCCOCCOCCCc1ccc(/C=C/c2ccc(/C=C/c3ccc(OCCOCCOCCOCCOC)cc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.50
PPARA Q07869 2/20 0.50
ALDH1A1 P00352 2/20 0.49
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MEN1 O00255 1/20 0.49
USP2 O75604 1/20 0.49
CYP3A4 P08684 1/20 0.49
MAPK1 P28482 1/20 0.49
CASP1 P29466 1/20 0.49
KMT2A Q03164 1/20 0.49
SLCO1B3 Q9NPD5 1/20 0.49
SLCO1B1 Q9Y6L6 1/20 0.49
APP P05067 4/20 0.48
AHR P35869 1/20 0.46
KDM4E B2RXH2 1/20 0.42
RECQL P46063 1/20 0.42
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
CHRNB4 P30926 1/20 0.40

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
SCHEMBL10069015 0.87 APP (0.58) ALDH1A1MEN1KMT2AAPPAHR
SCHEMBL22386553 0.85 MEN1 (0.63) PPARGPPARAALDH1A1LMNASMN1; SMN2
SCHEMBL15355647 0.84 APP (0.52) ALDH1A1LMNACYP3A4APPAHR
SCHEMBL20024696 0.82 AHR (0.56) ALDH1A1MEN1KMT2AAPPAHR
SCHEMBL19142219 0.80 APP (0.55) ALDH1A1LMNASMN1; SMN2MEN1USP2
SCHEMBL25567286 0.79 MEN1 (0.63) PPARGPPARAALDH1A1LMNASMN1; SMN2
SCHEMBL17230493 0.79 TDP1 (0.55) APP
SCHEMBL23266068 0.79 MEN1 (0.67) ALDH1A1LMNASMN1; SMN2MEN1USP2
SCHEMBL2332173 0.79 MEN1 (0.55) ALDH1A1LMNASMN1; SMN2MEN1USP2
SCHEMBL2325119 0.79 MEN1 (0.55) ALDH1A1LMNASMN1; SMN2MEN1USP2

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-20200277406-A1 BINDING AGENT ROCHE DIAGNOSTICS GMBH (DE) 2020-09-03 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-20200277406-A1 BINDING AGENT SSB, APBA1, SHBG PPARG 4175/4885PPARA 3055/4885ALDH1A1 2473/4885

“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.