SCHEMBL1492710

SCHEMBL1492710

CC1(C)C=[C]c2cc(Cl)ccc2O1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.38
KCNE1 P15382 1/20 0.32
KCNQ1 P51787 1/20 0.32
HIF1A Q16665 1/20 0.30
EPAS1 Q99814 1/20 0.30
HTR2C P28335 2/20 0.30
PGR P06401 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP3A4 P08684 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
HTR2A P28223 1/20 0.30

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
SCHEMBL1492658 0.80 AHR (0.36) AHR
SCHEMBL8307384 0.76 ABCB1 (0.38) KCNE1KCNQ1CYP3A4
SCHEMBL7294563 0.69 AHR (0.36) AHRKCNE1KCNQ1HTR2C
SCHEMBL9219622 0.67 HTR2C (0.54) AHRHIF1AEPAS1HTR2CALDH1A1
SCHEMBL11858013 0.66 TSHR (0.56) AHRKCNE1KCNQ1HTR2CALDH1A1
SCHEMBL29561949 0.66 TSHR (0.56) AHRKCNE1KCNQ1HTR2CALDH1A1
SCHEMBL7298546 0.64 AHR (0.35) AHRHTR2C
SCHEMBL21966133 0.64 AHR (0.39) AHRKCNE1KCNQ1HTR2CPGR
SCHEMBL27739440 0.63 HTR2C (0.57) AHRHIF1AEPAS1HTR2CALDH1A1
SCHEMBL10651368 0.61 PSEN1 (0.40) AHRHIF1AEPAS1PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110118234-A1 Urea Compounds as Gamma Secretase Modulators AMGEN INC. 2011-05-19 US disclosed
EP-2300427-A1 UREA COMPOUNDS AS GAMMA SECRETASE MODULATORS AMGEN INC. (US) 2011-03-30 EP disclosed
WO-2009137404-A1 UREA COMPOUNDS AS GAMMA SECRETASE MODULATORS AMGEN INC. (US) 2009-11-12 WO 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-20110118234-A1 Urea Compounds as Gamma Secretase Modulators BACE1, BACE2, PSEN1 AHR 4457/4885KCNE1 3876/4885KCNQ1 4019/4885

“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.