SCHEMBL14192033

SCHEMBL14192033

CCC(O)(C(=O)NCc1cc(C(F)(F)F)cnc1OC)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
DGAT2 Q96PD7 5/20 0.40
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
CFTR P13569 1/20 0.40
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
PPARA Q07869 5/20 0.38
RIPK1 Q13546 3/20 0.38
PPARD Q03181 4/20 0.37
PPARG P37231 3/20 0.37
ALDH1A1 P00352 1/20 0.37
ATM Q13315 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
SCHEMBL5104284 1.00 LMNA (0.41) LMNADGAT2HDAC3HDAC1HDAC2
SCHEMBL5103509 0.95 EPHX2 (0.41) LMNADGAT2HDAC3HDAC1HDAC2
SCHEMBL14192034 0.95 EPHX2 (0.41) LMNADGAT2HDAC3HDAC1HDAC2
SCHEMBL14192036 0.95 CFTR (0.44) LMNADGAT2CFTRMEN1POLB
SCHEMBL5107522 0.95 CFTR (0.44) LMNADGAT2CFTRMEN1POLB
SCHEMBL14192035 0.90 LMNA (0.46) LMNAMEN1POLBKMT2ARIPK1
SCHEMBL5107357 0.90 LMNA (0.46) LMNAMEN1POLBKMT2ARIPK1
SCHEMBL14192032 0.90 KMT2A (0.40) LMNADGAT2CFTRMEN1POLB
SCHEMBL5112994 0.90 KMT2A (0.40) LMNADGAT2CFTRMEN1POLB
SCHEMBL5114091 0.88 CFTR (0.39) DGAT2CFTRPPARA

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 LMNA 1068/4885DGAT2 3284/4885HDAC3 816/4885

“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.