SCHEMBL4861283

SCHEMBL4861283

COCC(O)CONC(=O)c1cccc(F)c1F

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.47
MAP2K1 Q02750 8/20 0.43
MAP2K2 P36507 3/20 0.43
BRAF P15056 1/20 0.43
MAP2K5 Q13163 1/20 0.43
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
BCHE P06276 1/20 0.41
ADRB2 P07550 3/20 0.39
ADRB1 P08588 3/20 0.39
ADRB3 P13945 3/20 0.39
KAT6A Q92794 1/20 0.39
AURKA O14965 1/20 0.38
RPS6KB1 P23443 1/20 0.38
PSMB5 P28074 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL6295970 0.89 MAPK1 (0.47) MAPK1MAP2K1MAP2K2BRAFMAP2K5
SCHEMBL6291256 0.85 CES2 (0.45) MAPK1MAP2K1MAP2K2BRAFMAP2K5
SCHEMBL6295965 0.85 CES2 (0.47) MAP2K1MAP2K2CES2CES1BCHE
SCHEMBL4862035 0.85 KAT6A (0.45) MAPK1MAP2K1MAP2K2BRAFMAP2K5
SCHEMBL6295843 0.81 CES2 (0.44) MAP2K1MAP2K2CES2CES1BCHE
SCHEMBL4851679 0.81 CES2 (0.44) MAPK1MAP2K1MAP2K2BRAFMAP2K5
SCHEMBL29941199 0.77 MAP2K1 (0.52) MAP2K1MAP2K2CES2CES1BCHE
SCHEMBL27534743 0.77 MAP2K1 (0.64) MAPK1MAP2K1MAP2K2BRAFMAP2K5
SCHEMBL6291672 0.77 MAP2K1 (0.50) MAPK1MAP2K1MAP2K2BRAFMAP2K5
SCHEMBL27218132 0.77 CES2 (0.55) CES2CES1BCHEKAT6AALDH1A1

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-7411001-B2 Oxygenated esters of 4-iodo phenylamino benzhydroxamic acids WARNER-LAMBERT COMPANY (US) 2008-08-12 US disclosed
US-20050176820-A1 Oxygenated esters of 4-iodo phenylamino benzhydroxamic acids WARNER-LAMBERT COMPANY 2005-08-11 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-20050176820-A1 Oxygenated esters of 4-iodo phenylamino benzhydroxamic acids CYP4X1, CYP2A7, CYP4B1 MAPK1 4734/4885MAP2K1 4341/4885MAP2K2 4268/4885

“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.