SCHEMBL19989690

SCHEMBL19989690

COCC#Cc1ccc(C2=CCN(C(=O)OC(C)(C)C)CC2)cn1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 10/20 0.52
NAMPT P43490 1/20 0.47
CYP11B2 P19099 1/20 0.45
GRM1 Q13255 10/20 0.44
PDK4 Q16654 1/20 0.43
WNT3A P56704 1/20 0.43
ATR Q13535 1/20 0.42
BTK Q06187 1/20 0.42
GPR119 Q8TDV5 1/20 0.42
CDK7 P50613 1/20 0.41
CDK13 Q14004 1/20 0.41
CDK12 Q9NYV4 1/20 0.41
BRD4 O60885 1/20 0.41

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
SCHEMBL23716667 0.87 DRD2 (0.41) GRM5NAMPT
SCHEMBL12686774 0.84 GPR119 (0.55) GRM5NAMPTCYP11B2GRM1PDK4
SCHEMBL29580437 0.79 NAMPT (0.53) GRM5NAMPTCYP11B2GRM1PDK4
SCHEMBL22324763 0.79 NAMPT (0.53) GRM5NAMPTCYP11B2GRM1PDK4
SCHEMBL29891644 0.79 NAMPT (0.55) GRM5NAMPTCYP11B2GRM1PDK4
SCHEMBL29840400 0.79 NAMPT (0.55) GRM5NAMPTCYP11B2GRM1PDK4
SCHEMBL29840385 0.79 NAMPT (0.55) GRM5NAMPTCYP11B2GRM1PDK4
SCHEMBL23306173 0.79 NAMPT (0.55) GRM5NAMPTCYP11B2GRM1PDK4
SCHEMBL15095872 0.79 NAMPT (0.55) GRM5NAMPTCYP11B2GRM1PDK4
SCHEMBL1577504 0.79 NAMPT (0.53) GRM5NAMPTCYP11B2GRM1PDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3519387-B1 TETRAHYDROPYRIDINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS DONG A ST CO LTD (KR) 2021-08-11 EP disclosed
EP-3519387-A1 TETRAHYDROPYRIDINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS Dong-A ST Co., Ltd. (KR) 2019-08-07 EP disclosed
US-10160724-B2 Tetrahydropyridine derivatives and their use as antibacterial agents DONG-A ST CO., LTD. (KR) 2018-12-25 US disclosed
WO-2018062924-A1 TETRAHYDROPYRIDINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS DONG-A ST CO., LTD. (KR) 2018-04-05 WO disclosed
US-20180086709-A1 TETRAHYDROPYRIDINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS DONG-A ST CO., LTD. (KR) 2018-03-29 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 (2 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-20180086709-A1 TETRAHYDROPYRIDINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS GALE, UGDH, PGLS GRM5 1014/4885NAMPT 94/4885CYP11B2 4520/4885
US-10160724-B2 Tetrahydropyridine derivatives and their use as antibacterial agents GALE, UGDH, PGLS GRM5 1014/4885NAMPT 94/4885CYP11B2 4520/4885

“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.