SCHEMBL5100174

SCHEMBL5100174

COc1ncc(C(F)(F)F)cc1CNC(=O)C(O)(c1ccccc1)C(F)(F)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CFTR P13569 3/20 0.43
CETP P11597 1/20 0.41
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.39
DGAT2 Q96PD7 4/20 0.38
PPARG P37231 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
EPHX2 P34913 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
GLA P06280 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LIPE Q05469 1/20 0.37
VNN1 O95497 1/20 0.36

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
SCHEMBL5106570 1.00 CFTR (0.43) CFTRCETPMEN1POLBKMT2A
SCHEMBL5107338 0.94 CETP (0.46) CFTRCETPMEN1POLBKMT2A
SCHEMBL5107542 0.94 CETP (0.46) CFTRCETPMEN1POLBKMT2A
SCHEMBL5113222 0.85 CFTR (0.43) CFTRCETP
SCHEMBL5107522 0.85 CFTR (0.44) CFTRMEN1POLBKMT2ALMNA
SCHEMBL14192036 0.85 CFTR (0.44) CFTRMEN1POLBKMT2ALMNA
SCHEMBL5104284 0.80 LMNA (0.41) CFTRMEN1POLBKMT2ALMNA
SCHEMBL14192033 0.80 LMNA (0.41) CFTRMEN1POLBKMT2ALMNA
SCHEMBL4322706 0.80 CETP (0.37) CETPMEN1POLBKMT2ADGAT2
SCHEMBL13892428 0.80 CETP (0.37) CETPMEN1POLBKMT2ADGAT2

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 12 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 claimed
EP-1807076-A1 N-(PYRIDIN-3-YL)-2-PHENYLBUTANAMIDES AS ANDROGEN RECEPTOR MODULATORS Merck & Co., Inc. (US) 2007-07-18 EP claimed
WO-2006060108-A1 N-(PYRIDIN-3-YL)-2-PHENYLBUTANAMIDES AS ANDROGEN RECEPTOR MODULATORS MERCK & CO., INC. (US) 2006-06-08 WO claimed
US-20230122310-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2023-04-20 US disclosed
WO-2022204184-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NUVATION BIO INC. (US) 2022-09-29 WO disclosed
US-20210214316-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2021-07-15 US disclosed
WO-2021097046-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NUVATION BIO INC. (US) 2021-05-20 WO disclosed
US-20200360523-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2020-11-19 US disclosed
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
EP-1807076-A1 N-(PYRIDIN-3-YL)-2-PHENYLBUTANAMIDES AS ANDROGEN RECEPTOR MODULATORS Merck & Co., Inc. (US) 2007-07-18 EP disclosed
WO-2006060108-A1 N-(PYRIDIN-3-YL)-2-PHENYLBUTANAMIDES AS ANDROGEN RECEPTOR MODULATORS MERCK & CO., INC. (US) 2006-06-08 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 (4 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-20210214316-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NCOA1, NCOR1, NCOA3 CFTR 3585/4885CETP 1337/4885MEN1 2250/4885
US-20080124402-A1 N-(Pyridin-3-Yl)-2-Phenylbutanamides As Androgen Receptor Modulators SHBG, AR, NR5A1 CFTR 4732/4885CETP 3546/4885MEN1 2668/4885
US-20200360523-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NCOA1, NCOR1, NCOA3 CFTR 3585/4885CETP 1337/4885MEN1 2250/4885
US-20230122310-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NCOA1, NCOR1, NCOA3 CFTR 3585/4885CETP 1337/4885MEN1 2250/4885

“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.