SCHEMBL14192007

SCHEMBL14192007

COc1ncc(C2CC2)cc1CN

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 0.40
SSTR5 P35346 1/20 0.39
CFTR P13569 3/20 0.36
AURKA O14965 1/20 0.33
TTK P33981 1/20 0.33
AURKB Q96GD4 1/20 0.33
INCENP Q9NQS7 1/20 0.33
PIK3CA P42336 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
SSTR4 P31391 1/20 0.33
DHODH Q02127 1/20 0.33
KDM4E B2RXH2 1/20 0.33
FPR2 P25090 2/20 0.32
KDM1A O60341 3/20 0.32
MAOB P27338 1/20 0.32
CARM1 Q86X55 1/20 0.31
HTR2A P28223 1/20 0.31
MAPT P10636 1/20 0.31
CASP1 P29466 1/20 0.31

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
SCHEMBL14192011 0.84 SSTR5 (0.41) PDGFRBPDGFRASSTR5CFTRSSTR4
SCHEMBL20789989 0.78 PDGFRB (0.44) PDGFRBPDGFRASSTR5CFTRPIK3CA
SCHEMBL16877079 0.76 PDGFRB (0.44) PDGFRBPDGFRASSTR5AURKATTK
SCHEMBL20789999 0.75 PDGFRB (0.42) PDGFRBPDGFRASSTR5CFTRCARM1
SCHEMBL17071870 0.75 PDGFRB (0.43) PDGFRBPDGFRAAURKATTKAURKB
SCHEMBL16877076 0.75 PDGFRB (0.43) PDGFRBPDGFRASSTR5AURKATTK
SCHEMBL30005112 0.75 PDGFRB (0.43) PDGFRBPDGFRAAURKATTKAURKB
SCHEMBL20670339 0.74 SLC13A5 (0.47) AURKATTKAURKBINCENPKDM4E
SCHEMBL14192009 0.73 CFTR (0.39) PDGFRBPDGFRASSTR5CFTRSSTR4
SCHEMBL25117788 0.73 CYP2C9 (0.42) AURKATTKAURKBINCENPKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080124402-A1 N-(Pyridin-3-Yl)-2-Phenylbutanamides As Androgen Receptor Modulators MERCK & CO., INC. (US) 2008-05-29 US disclosed
US-20080124402-A1 N-(Pyridin-3-Yl)-2-Phenylbutanamides As Androgen Receptor Modulators MERCK & CO., INC. (US) 2008-05-29 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-20080124402-A1 N-(Pyridin-3-Yl)-2-Phenylbutanamides As Androgen Receptor Modulators SHBG, AR, NR5A1 PDGFRB 258/4885PDGFRA 981/4885SSTR5 2730/4885

“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.