SCHEMBL5363596

SCHEMBL5363596

CC(C)(C)OC(=O)N1CCN(c2cccc3ccncc23)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.53
ACHE P22303 2/20 0.51
PHGDH O43175 1/20 0.51
GPR119 Q8TDV5 8/20 0.50
CKS1B P61024 2/20 0.49
SKP1 P63208 2/20 0.49
SKP2 Q13309 2/20 0.49
BACE1 P56817 1/20 0.48
CYP11B2 P19099 1/20 0.48
KIT P10721 1/20 0.48
P2RX7 Q99572 1/20 0.47
POLB P06746 1/20 0.45
SMARCA2 P51531 1/20 0.44
SMARCA4 P51532 1/20 0.44
PBRM1 Q86U86 1/20 0.44

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
SCHEMBL2416196 0.91 CYP11B2 (0.56) GBA1ACHEPHGDHGPR119CKS1B
SCHEMBL4558301 0.85 BACE1 (0.59) GBA1ACHEGPR119CKS1BSKP1
SCHEMBL17114986 0.84 MAP4K4 (0.47) GBA1PHGDHGPR119CYP11B2
SCHEMBL17114988 0.84 MAP4K4 (0.47) GBA1PHGDHGPR119CYP11B2
SCHEMBL5358513 0.81 TRPV1 (0.50) PHGDHP2RX7
SCHEMBL30368857 0.81 GPR119 (0.53) GPR119
SCHEMBL19297041 0.81 GPR119 (0.53) GPR119
SCHEMBL23360685 0.80 DYRK1A (0.53) ACHEGPR119
SCHEMBL29863072 0.80 DYRK1A (0.53) ACHEGPR119
SCHEMBL19297108 0.80 GPR119 (0.49) GBA1GPR119CKS1BSKP1SKP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7157463-B2 Substituted piperidines/piperazines as melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-02 US disclosed
US-7157463-B2 Substituted piperidines/piperazines as melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-02 US disclosed
US-7157463-B2 Substituted piperidines/piperazines as melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-02 US disclosed
US-20040058936-A1 Substituted piperidines/piperazines as melanocortin receptor agonists ELI LILLY AND COMPANY 2004-03-25 US disclosed
EP-1368339-A1 SUBSTITUTED PIPERIDINES/PIPERAZINES AS MELANOCORTIN RECEPTOR AGONISTS Eli Lilly & Company (US) 2003-12-10 EP disclosed
WO-2002059107-A1 SUBSTITUTED PIPERIDINES/PIPERAZINES AS MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2002-08-01 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-20040058936-A1 Substituted piperidines/piperazines as melanocortin receptor agonists MC1R, MC4R, MC5R GBA1 2462/4885ACHE 4528/4885PHGDH 4335/4885

“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.