SCHEMBL4186993

SCHEMBL4186993

Cc1ccccc1COc1ccc(C#N)c(Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.60
MRGPRX4 Q96LA9 2/20 0.51
MAOB P27338 4/20 0.49
ACHE P22303 1/20 0.46
KDM4E B2RXH2 1/20 0.44
PGR P06401 1/20 0.43
CCNB2 O95067 1/20 0.43
CDK1 P06493 1/20 0.43
CDK4 P11802 1/20 0.43
CCNB1 P14635 1/20 0.43
CCND1 P24385 1/20 0.43
CCNB3 Q8WWL7 1/20 0.43
SLC26A4 O43511 1/20 0.43
ALOX5 P09917 1/20 0.42
ALOX5AP P20292 1/20 0.42
SLC22A12 Q96S37 2/20 0.42

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
SCHEMBL4198833 0.84 AR (0.54) ARMRGPRX4MAOBPGRSLC22A12
SCHEMBL14618854 0.83 MRGPRX4 (0.54) ARMRGPRX4MAOBSLC22A12
SCHEMBL4200879 0.83 AR (0.53) ARMRGPRX4MAOBSLC22A12
SCHEMBL27459957 0.80 ALOX5 (0.54) MAOBACHEKDM4ECCNB2CDK1
SCHEMBL4075116 0.80 MAOB (0.74) ARMRGPRX4MAOBALOX5
SCHEMBL6214015 0.78 PTGDR2 (0.47) ARMRGPRX4CDK4CCND1
SCHEMBL23235776 0.77 MAOB (0.59) MAOBACHEKDM4ECCNB2CDK1
SCHEMBL4202298 0.77 MRGPRX4 (0.66) ARMRGPRX4MAOBACHE
SCHEMBL4175953 0.75 AR (1.00) ARPGRSLC22A12
SCHEMBL13577008 0.75 ACHE (0.49) MAOBACHEKDM4ECCNB2CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170886-A1 ANDROGEN MODULATORS PFIZER INC 2009-07-02 US disclosed
US-20090170886-A1 ANDROGEN MODULATORS PFIZER INC 2009-07-02 US disclosed
US-20090170886-A1 ANDROGEN MODULATORS PFIZER INC 2009-07-02 US disclosed
WO-2007017754-A2 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2007-02-15 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-20090170886-A1 ANDROGEN MODULATORS AR, NR5A1, SHBG AR 1/4885MRGPRX4 1139/4885MAOB 1336/4885

“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.