SCHEMBL14192014

SCHEMBL14192014

CC[C@H](C(=O)NCc1cc(C2CC2)cnc1OC)c1cccc(F)c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT2 Q96PD7 2/20 0.41
KCNQ2 O43526 1/20 0.40
GAA P10253 1/20 0.39
HDAC4 P56524 2/20 0.38
CFTR P13569 1/20 0.38
FFAR1 O14842 1/20 0.37
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
MAPK1 P28482 2/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ROCK2 O75116 1/20 0.35
PRKG1 Q13976 1/20 0.35
DHODH Q02127 1/20 0.35
SSTR5 P35346 1/20 0.34

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
SCHEMBL27679152 1.00 DGAT2 (0.41) DGAT2KCNQ2GAAHDAC4CFTR
SCHEMBL14192016 0.90 DGAT2 (0.39) DGAT2KCNQ2GAAHDAC4CFTR
SCHEMBL27679154 0.90 DGAT2 (0.39) DGAT2KCNQ2GAAHDAC4CFTR
SCHEMBL14192012 0.90 GAA (0.49) GAACFTRMEN1KMT2ADHODH
SCHEMBL27698248 0.89 KCNQ2 (0.40) DGAT2KCNQ2GAACFTRMAPK1
SCHEMBL14192019 0.89 KCNQ2 (0.40) DGAT2KCNQ2GAACFTRMAPK1
SCHEMBL27679155 0.89 DGAT2 (0.52) DGAT2HDAC4FFAR1CARM1PRMT6
SCHEMBL14192013 0.89 DGAT2 (0.52) DGAT2HDAC4FFAR1CARM1PRMT6
SCHEMBL14192025 0.89 KCNQ2 (0.43) DGAT2KCNQ2GAACFTRMAPK1
SCHEMBL14192018 0.88 DGAT2 (0.43) DGAT2KCNQ2GAAHDAC4CFTR

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 DGAT2 3284/4885KCNQ2 3704/4885GAA 3197/4885

“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.