SCHEMBL4904875

SCHEMBL4904875

CC(C(=O)N(C)C)N(CCc1ccccc1)c1ccc(C#N)c(Cl)c1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PGR P06401 20/20 0.69
AR P10275 1/20 0.49
CYP2D6 P10635 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 7/20 0.41

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
SCHEMBL4904881 1.00 PGR (0.69) PGRARCYP2D6CYP2C9CYP2C19
SCHEMBL4904251 0.88 PGR (0.81) PGRARCYP2C19
SCHEMBL4904248 0.88 PGR (0.81) PGRARCYP2C19
SCHEMBL4898472 0.83 PGR (0.72) PGRARCYP2C19
SCHEMBL4898474 0.83 PGR (0.72) PGRARCYP2C19
SCHEMBL4896095 0.82 PGR (1.00) PGRARCYP2C19
SCHEMBL4896105 0.82 PGR (1.00) PGRARCYP2C19
SCHEMBL4595785 0.74 AR (0.74) PGRARCYP2D6CYP2C9
SCHEMBL4595784 0.74 AR (0.74) PGRARCYP2D6CYP2C9
SCHEMBL4596260 0.73 PGR (0.83) PGRARCYP2C19

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-20080194536-A1 Cyanoarylamines SMITHKLINE BEECHAM CORPORATION 2008-08-14 US claimed
US-20080194536-A1 Cyanoarylamines SMITHKLINE BEECHAM CORPORATION 2008-08-14 US disclosed
US-20080194536-A1 Cyanoarylamines SMITHKLINE BEECHAM CORPORATION 2008-08-14 US disclosed
US-20080194536-A1 Cyanoarylamines SMITHKLINE BEECHAM CORPORATION 2008-08-14 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 (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-20080194536-A1 Cyanoarylamines EDNRA, CYP19A1, HSD17B11 PGR 64/4885AR 84/4885CYP2D6 622/4885

“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.