SCHEMBL4178023

SCHEMBL4178023

COc1ccccc1Oc1ccc(C#N)c(Cl)c1

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 11/20 0.74
PGR P06401 2/20 0.55
POLB P06746 1/20 0.54
GAA P10253 1/20 0.54
SLC22A12 Q96S37 4/20 0.54
ALDH1A1 P00352 1/20 0.53
MAPK1 P28482 1/20 0.53
HTT P42858 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
ESRRA P11474 1/20 0.53

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
SCHEMBL4181110 0.87 AR (0.64) ARPGRPOLBGAASLC22A12
SCHEMBL5501269 0.87 AR (0.57) ARPGRPOLBGAASLC22A12
SCHEMBL4168098 0.87 AR (0.65) ARPGRPOLBGAASLC22A12
SCHEMBL4182051 0.86 AR (0.59) ARPGRSLC22A12ESRRA
SCHEMBL753907 0.86 AR (0.75) ARPGRPOLBGAASLC22A12
SCHEMBL13890551 0.86 AR (0.75) ARPOLBGAASLC22A12
SCHEMBL4175953 0.85 AR (1.00) ARPGRPOLBGAASLC22A12
SCHEMBL4178475 0.84 AR (0.68) ARPGRPOLBGAASLC22A12
SCHEMBL4172657 0.84 AR (0.68) ARPGRPOLBGAASLC22A12
SCHEMBL4181860 0.84 AR (0.67) ARPGRSLC22A12ESRRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105349-A1 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2009-04-23 US claimed
US-20090105349-A1 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2009-04-23 US disclosed
US-20090105349-A1 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2009-04-23 US disclosed
US-20090105349-A1 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2009-04-23 US disclosed
EP-1781280-A2 ANDROGEN MODULATORS Warner-Lambert Company LLC (US) 2007-05-09 EP disclosed
WO-2006018723-A2 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2006-02-23 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-20090105349-A1 ANDROGEN MODULATORS AR, NR5A1, SHBG AR 1/4885PGR 48/4885POLB 2022/4885

“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.