SCHEMBL6174036

SCHEMBL6174036

O=C(O)CN(C(=O)c1ccc(F)cc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.51
CXCR2 P25025 1/20 0.51
ACHE P22303 1/20 0.49
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
MAPT P10636 1/20 0.49
RECQL P46063 1/20 0.49
MLYCD O95822 1/20 0.46
HPGD P15428 1/20 0.46
NPC1 O15118 1/20 0.46
MAPK14 Q16539 1/20 0.44
AGER Q15109 2/20 0.43
MTNR1A P48039 1/20 0.43
PTPN1 P18031 1/20 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
SCHEMBL10349935 0.93 MEN1 (0.56) ADRA2CCXCR2ACHEKMT2AMEN1
SCHEMBL6176562 0.93 CXCR2 (0.50) ADRA2CCXCR2ACHEKMT2AMEN1
SCHEMBL698882 0.88 ADRA2C (0.64) ADRA2CKMT2AMEN1MLYCDHPGD
SCHEMBL9716677 0.85 ADRA2C (0.53) ADRA2CKMT2AMEN1MAPTMLYCD
SCHEMBL10660695 0.83 BACE1 (0.52) ADRA2CKMT2AMEN1MAPTMLYCD
SCHEMBL6569544 0.83 PKM (0.56) ADRA2CKMT2AMEN1HPGDNPC1
SCHEMBL9716701 0.83 ADRA2C (0.55) ADRA2CKMT2AMEN1MAPTMLYCD
SCHEMBL27601299 0.81 SMN1; SMN2 (0.51) ACHEKMT2AMEN1MAPTRECQL
SCHEMBL10659082 0.80 ADRA2C (0.48) ADRA2CKMT2AMEN1MLYCDHPGD
SCHEMBL6570858 0.80 KDM4E (0.63) ADRA2CACHEKMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6949543-B2 Amide derivative YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-27 US disclosed
EP-1340750-B1 AMIDE DERIVATIVES YAMANOUCHI PHARMA CO LTD (JP) 2005-08-17 EP disclosed
US-20040034232-A1 Amide derivative ASTELLAS PHARMA INC. (JP) 2004-02-19 US disclosed
EP-1340750-A1 AMIDE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2003-09-03 EP disclosed
US-6008235-A Pyridyl substituted imidazoles SMITHKLINE BEECHAM CORPORATION (US) 1999-12-28 US disclosed
EP-0624159-B1 PYRIDYL SUBSTITUTED IMIDAZOLES SMITHKLINE BEECHAM CORP (US) 1998-11-25 EP disclosed
US-5716972-A Pyridyl substituted imidazoles SMITHKLINE BEECHAM CORPORATION (US) 1998-02-10 US disclosed
EP-0624159-A4 PYRIDYL SUBSTITUTED IMIDAZOLES. SMITHKLINE BEECHAM CORP (US) 1995-04-12 EP disclosed
EP-0624159-A1 PYRIDYL SUBSTITUTED IMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1994-11-17 EP disclosed
WO-1993014082-A1 PYRIDYL SUBSTITUTED IMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1993-07-22 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 (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-20040034232-A1 Amide derivative HDAC2, ZC3HAV1, HDAC4 ADRA2C 4531/4885CXCR2 1352/4885ACHE 2038/4885

“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.