SCHEMBL8534700

SCHEMBL8534700

CC(C)(C)C1C(Oc2ccc(Cl)nc2)CN1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 1/20 0.40
LIPG Q9Y5X9 1/20 0.40
CHRNA3 P32297 3/20 0.36
CHRNB2 P17787 3/20 0.35
CHRNA4 P43681 3/20 0.35
CHRNB4 P30926 2/20 0.35
CHRNB1 P11230 1/20 0.35
CHRNB3 Q05901 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
RAB9A P51151 1/20 0.35
TERT O14746 1/20 0.35
GRM4 Q14833 1/20 0.34
NAPRT Q6XQN6 1/20 0.34
KDM4E B2RXH2 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 1/20 0.33

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
SCHEMBL8534571 0.88 LPL (0.41) LPLLIPGCHRNA3CHRNB2CHRNA4
SCHEMBL8609796 0.83 LPL (0.41) LPLLIPGCHRNA3CHRNB2CHRNA4
SCHEMBL27147680 0.78 GRIN1 (0.37) CHRNA3CHRNB2CHRNA4CHRNB4NPC1
SCHEMBL25283897 0.77 HRH3 (0.41)
SCHEMBL25284056 0.77 HRH3 (0.41)
SCHEMBL25284293 0.77 HRH3 (0.41)
SCHEMBL25288935 0.77 HRH3 (0.41)
SCHEMBL8530303 0.75 LPL (0.47) LPLLIPGCHRNA3CHRNB2CHRNA4
SCHEMBL25286887 0.73 HRH3 (0.46)
SCHEMBL25287926 0.73 HRH3 (0.46)

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-9000175-B2 Bicyclic GPR119 modulators LUPIN LIMITED (IN) 2015-04-07 US disclosed
EP-2643311-A1 BICYCLIC GPR119 MODULATORS Lupin Limited (IN) 2013-10-02 EP disclosed
US-20130245000-A1 BICYCLIC GPR119 MODULATORS LUPIN LIMITED (IN) 2013-09-19 US disclosed
WO-2012069917-A1 BICYCLIC GPR119 MODULATORS LUPIN LIMITED (IN) 2012-05-31 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-20130245000-A1 BICYCLIC GPR119 MODULATORS GPR119, GPR180, GPBAR1 LPL 1140/4885LIPG 857/4885CHRNA3 392/4885

“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.