Sugi Predict

Sugi Predict / Compounds / SCHEMBL17826404

SCHEMBL17826404

SCHEMBL17826404

CCCCCOc1cc(C)c(Sc2cc(C(C)(C)C)c(C)cc2C)cc1C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ THRA P10827 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ ESR1 P03372 3/20 0.38
▸ HTT P42858 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ TLR8 Q9NR97 2/20 0.33

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
SCHEMBL17812885 0.96 ALDH1A1 (0.46) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL17264210 0.78 ESR1 (0.45) ALDH1A1THRATHRBESR1TLR8
SCHEMBL17826412 0.77 TP53 (0.53) ALDH1A1TP53ALOX15TDP1THRA
SCHEMBL13412674 0.77 ESR1 (0.47) ALDH1A1THRATHRBESR1TLR8
SCHEMBL13341488 0.77 THRA (0.51) CYP3A4THRATHRBESR1HTT
SCHEMBL11138643 0.77 THRA (0.51) CYP3A4THRATHRBESR1HTT
SCHEMBL17826417 0.76 ALDH1A1 (0.67) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL25499770 0.76 ALDH1A1 (0.50) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL12608288 0.74 ALDH1A1 (0.42) ALDH1A1TP53CYP3A4ALOX15TSHR
SCHEMBL6232233 0.73 THRA (0.43) ALDH1A1TP53CYP3A4ALOX15MAPK1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170306255-A1 Fuel Markers and Methods of Producing and Using Same AUTHENTIX, INC. 2017-10-26 — — US disclosed
US-9732296-B2 Fuel markers and methods of producing and using same AUTHENTIX, INC. (US) 2017-08-15 — — US disclosed
US-9631152-B2 Fuel markers and methods of producing and using same AUTHENTIX, INC. (US) 2017-04-25 — — US disclosed
US-20160272905-A1 Fuel Markers and Methods of Producing and Using Same AUTHENTIX, INC. 2016-09-22 — — US disclosed
US-20160272906-A1 Fuel Markers and Methods of Producing and Using Same AUTHENTIX, INC. 2016-09-22 — — US disclosed
US-20160272907-A1 Fuel Markers and Methods of Producing and Using Same AUTHENTIX, INC. 2016-09-22 — — US disclosed
US-9366661-B1 Fuel markers and methods of producing and using same AUTHENTIX, INC. (US) 2016-06-14 — — 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 (3 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-20160272905-A1 Fuel Markers and Methods of Producing and Using Same CBR1, CBR3, FADS1 ALDH1A1 1281/4885TP53 4357/4885CYP3A4 645/4885
US-20170306255-A1 Fuel Markers and Methods of Producing and Using Same CBR1, CBR3, FADS1 ALDH1A1 1281/4885TP53 4357/4885CYP3A4 645/4885
US-20160272907-A1 Fuel Markers and Methods of Producing and Using Same CBR3, CBR1, CYC1 ALDH1A1 1392/4885TP53 4053/4885CYP3A4 801/4885

“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.