SCHEMBL2888036

SCHEMBL2888036

CC(C)c1noc(CN2CC(Oc3ccc(-c4ccc(C(=O)N[C@H](C)CO)c(F)c4)nc3)C2)n1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 10/20 0.44
HDAC6 Q9UBN7 8/20 0.44
GPR119 Q8TDV5 2/20 0.44
HDAC1 Q13547 1/20 0.39
ALOX5AP P20292 3/20 0.38
FEN1 P39748 3/20 0.38
ACACB O00763 1/20 0.36
SYK P43405 1/20 0.36
P2RX3 P56373 2/20 0.36
P2RX2 Q9UBL9 2/20 0.36
MAPK1 P28482 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
SCHEMBL2891859 0.94 HDAC4 (0.39) HDAC4HDAC6GPR119HDAC1MAPK1
SCHEMBL2906289 0.92 HDAC4 (0.37) HDAC4HDAC6GPR119ACACBSYK
SCHEMBL2894005 0.90 MTOR (0.40) HDAC4HDAC6GPR119HDAC1ACACB
SCHEMBL13024281 0.89 GPR119 (0.39) GPR119
SCHEMBL2904085 0.88 GRM2 (0.40) GPR119MAPK1
SCHEMBL2893546 0.88 GPR119 (0.38) GPR119
SCHEMBL2893540 0.88 GPR119 (0.38) GPR119ACACB
SCHEMBL2893913 0.86 GPR119 (0.35) GPR119ACACBMAPK1
SCHEMBL2891626 0.86 GPR119 (0.38) GPR119ACACBMAPK1
SCHEMBL3663119 0.86 GPR119 (0.37) GPR119ACACBMAPK1

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-20100286110-A1 AZETIDINYL G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2010-11-11 US disclosed
US-20100286110-A1 AZETIDINYL G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2010-11-11 US disclosed
US-20100286110-A1 AZETIDINYL G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2010-11-11 US disclosed
WO-2009050523-A1 AZETIDINYL G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2009-04-23 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-20100286110-A1 AZETIDINYL G-PROTEIN COUPLED RECEPTOR AGONISTS GPR119, GIPR, GPR39 HDAC4 4352/4885HDAC6 4057/4885GPR119 1/4885

“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.