SCHEMBL4664059

SCHEMBL4664059

CC(C)(C)OC(=O)c1cc(Br)cc2c1N(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.45
ALDH1A1 P00352 4/20 0.42
GAA P10253 2/20 0.42
PKM P14618 1/20 0.42
HSD17B10 Q99714 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
LMNA P02545 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
ESR2 Q92731 1/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
CASP6 P55212 1/20 0.38
GPR119 Q8TDV5 1/20 0.38
NR1H2 P55055 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
UCHL1 P09936 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
SCHEMBL552657 0.93 POLB (0.47) POLBALDH1A1GAAPKMHSD17B10
SCHEMBL10211381 0.90 POLB (0.45) POLBALDH1A1GAAPKMHSD17B10
SCHEMBL13322052 0.89 POLB (0.48) POLBALDH1A1GAAPKMHSD17B10
SCHEMBL10211383 0.86 TSHR (0.46) POLBALDH1A1GAAPKMHSD17B10
SCHEMBL23063876 0.84 GPR119 (0.48) POLBALDH1A1GAAPKMHSD17B10
SCHEMBL14693395 0.83 POLB (0.46) POLBALDH1A1GAAPKMHSD17B10
SCHEMBL29723775 0.82 GPR119 (0.50) POLBALDH1A1GAAPKMHSD17B10
SCHEMBL27181889 0.82 GPR119 (0.50) POLBALDH1A1GAAPKMHSD17B10
SCHEMBL10267719 0.82 POLB (0.37) POLBALDH1A1GAAPKMHSD17B10
SCHEMBL4667607 0.81 USP30 (0.40) ESR2GPR119NR1H2UCHL1USP30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293802-A1 Chemical Compounds SMITHLINE BEECHAM CORPORATION 2008-11-27 US disclosed
US-20080293802-A1 Chemical Compounds SMITHLINE BEECHAM CORPORATION 2008-11-27 US disclosed
US-20080293802-A1 Chemical Compounds SMITHLINE BEECHAM CORPORATION 2008-11-27 US disclosed
WO-2007076286-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-07-05 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-20080293802-A1 Chemical Compounds IKBKG, NFKBIA, IDO2 POLB 1978/4885ALDH1A1 2429/4885GAA 4166/4885

“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.