SCHEMBL3010300

SCHEMBL3010300

FC1(C2N[C@@H](c3nc(-c4ccccc4)c[nH]3)Cc3c2[nH]c2ccccc32)CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SSTR3 P32745 18/20 0.46
KCNH2 Q12809 12/20 0.45
CACNA1F O60840 1/20 0.45
CACNA1D Q01668 1/20 0.45
CACNA1S Q13698 1/20 0.45
CACNA1C Q13936 1/20 0.45

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
SCHEMBL3807240 1.00 SSTR3 (0.46) SSTR3KCNH2CACNA1FCACNA1DCACNA1S
SCHEMBL13244716 0.80 SSTR3 (0.69) SSTR3KCNH2CACNA1FCACNA1DCACNA1S
SCHEMBL3020297 0.77 SSTR3 (0.49) SSTR3KCNH2CACNA1FCACNA1DCACNA1S
SCHEMBL6717602 0.74 SSTR3 (0.65) SSTR3KCNH2CACNA1FCACNA1DCACNA1S
SCHEMBL6717600 0.74 SSTR3 (0.65) SSTR3KCNH2CACNA1FCACNA1DCACNA1S
SCHEMBL6716252 0.72 SSTR3 (0.69) SSTR3KCNH2
SCHEMBL3010196 0.72 SSTR3 (0.50) SSTR3KCNH2CACNA1FCACNA1DCACNA1S
SCHEMBL3008099 0.72 SSTR3 (0.45) SSTR3KCNH2
SCHEMBL6716256 0.72 SSTR3 (0.69) SSTR3KCNH2
SCHEMBL13244752 0.72 SSTR3 (0.48) SSTR3KCNH2

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-20100184758-A1 BETA CARBOLINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS MERCK SHARP & DOHME CORP. 2010-07-22 US disclosed
US-20100184758-A1 BETA CARBOLINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS MERCK SHARP & DOHME CORP. 2010-07-22 US disclosed
US-20100184758-A1 BETA CARBOLINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS MERCK SHARP & DOHME CORP. 2010-07-22 US disclosed
WO-2009011836-A1 BETA CARBOLINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS MERCK & CO., INC. (US) 2009-01-22 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-20100184758-A1 BETA CARBOLINE DERIVATIVES AS ANTIDIABETIC COMPOUNDS GPR119, SSTR3, SSTR2 SSTR3 2/4885KCNH2 618/4885CACNA1F 669/4885

“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.