SCHEMBL4861675

SCHEMBL4861675

O=C(NOCC(O)COc1ccccc1)c1cc(F)c(F)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MTNR1A P48039 3/20 0.42
MTNR1B P49286 3/20 0.42
CYP2D6 P10635 2/20 0.42
ADRB2 P07550 2/20 0.42
ADRB1 P08588 2/20 0.42
ADRB3 P13945 2/20 0.42
CYP1A2 P05177 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL6291619 0.86 MAPT (0.51) MAPTLMNAPOLBNPSR1MEN1
SCHEMBL4862035 0.81 KAT6A (0.45) MAPTLMNAPOLBNPSR1MEN1
SCHEMBL4859968 0.81 MAPK1 (0.39) LMNAMAPK1
SCHEMBL4856514 0.76 CES2 (0.40) MAPTMAPK1
SCHEMBL4860860 0.74 MAP2K1 (0.66) MEN1KMT2AMAPK1
SCHEMBL4862103 0.73 MAP2K1 (0.58) MAPK1
SCHEMBL6291652 0.73 MAPK1 (0.76) MAPK1
SCHEMBL4864039 0.72 RHOC (0.44) MAPTNPSR1MEN1KMT2A
SCHEMBL11134305 0.72 MAPT (0.48) MAPTLMNAPOLBNPSR1MTNR1A
SCHEMBL267463 0.72 LMNA (0.68) MAPTLMNAPOLBNPSR1MEN1

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 MAPT 4731/4885LMNA 2385/4885POLB 2002/4885

“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.