SCHEMBL3014223

SCHEMBL3014223

Fc1ccc(-c2c[nH]c([C@H]3Cc4c([nH]c5ccccc45)C(Cn4cccn4)N3)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SSTR3 P32745 15/20 0.44
KCNH2 Q12809 9/20 0.44
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL3002454 0.77 SSTR3 (0.73) SSTR3KCNH2
SCHEMBL3008099 0.77 SSTR3 (0.45) SSTR3KCNH2KDM4EALDH1A1
SCHEMBL13244879 0.76 KDM4E (0.49) SSTR3KCNH2KDM4EALDH1A1
SCHEMBL3013321 0.75 SSTR3 (0.73) SSTR3KCNH2
SCHEMBL6717600 0.75 SSTR3 (0.65) SSTR3KCNH2
SCHEMBL6717602 0.75 SSTR3 (0.65) SSTR3KCNH2
SCHEMBL13244846 0.75 SSTR3 (0.44) SSTR3KCNH2
SCHEMBL13244822 0.74 SSTR3 (0.55) SSTR3KCNH2
SCHEMBL13244670 0.73 SSTR3 (0.46) SSTR3KCNH2
SCHEMBL13244848 0.73 SSTR3 (0.40) SSTR3KCNH2ALDH1A1

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 618/4885KDM4E 3971/4885

“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.