SCHEMBL1296354

SCHEMBL1296354

Cc1nc(OCCC(C)C2CCN(c3ncc(Cl)cn3)CC2)ccc1C(=O)NC(CO)CO

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 3/20 0.38
▸ GPR119 Q8TDV5 7/20 0.36
▸ KCNH2 Q12809 5/20 0.36
▸ MAPT P10636 2/20 0.35
▸ HCRTR1 O43613 1/20 0.35
▸ HCRTR2 O43614 1/20 0.35
▸ CNR2 P34972 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ PTPN11 Q06124 1/20 0.34
▸ GUCY1B2 O75343 1/20 0.34
▸ GUCY1A2 P33402 1/20 0.34
▸ GUCY1A1 Q02108 1/20 0.34
▸ GUCY1B1 Q02153 1/20 0.34
▸ IDH1 O75874 2/20 0.34
▸ P2RX3 P56373 1/20 0.34

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
SCHEMBL1296353 1.00 ACACB (0.38) ACACBGPR119KCNH2MAPTHCRTR1
SCHEMBL1296417 0.88 ACACB (0.35) ACACBGPR119KCNH2MAPTPOLB
SCHEMBL1296420 0.88 ACACB (0.35) ACACBGPR119KCNH2MAPTPOLB
SCHEMBL1294960 0.87 GPR119 (0.39) ACACBGPR119KCNH2MAPTHCRTR1
SCHEMBL1294970 0.87 GPR119 (0.39) ACACBGPR119KCNH2MAPTHCRTR1
SCHEMBL1295947 0.87 GPR119 (0.48) ACACBGPR119KCNH2CNR2GUCY1B2
SCHEMBL1296210 0.85 GPR119 (0.43) ACACBGPR119KCNH2CNR2
SCHEMBL1296208 0.85 GPR119 (0.43) ACACBGPR119KCNH2CNR2
SCHEMBL1296129 0.79 GPR119 (0.39) ACACBGPR119CNR2GUCY1B2GUCY1A2
SCHEMBL1296150 0.77 GPR119 (0.43) ACACBGPR119KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269734-A1 PIPERIDINYL GPCR AGONISTS PROSIDION LIMITED (GB) 2011-11-03 — — 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-20110269734-A1 PIPERIDINYL GPCR AGONISTS GPR119, GPR27, GLP1R ACACB 3305/4885GPR119 1/4885KCNH2 1416/4885

“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.

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