SCHEMBL6715730

SCHEMBL6715730

CCCCC1(CCCC)N[C@@H](c2nc(-c3ccccc3)cs2)Cc2c1[nH]c1ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SSTR3 P32745 19/20 1.00
KCNH2 Q12809 3/20 0.63
SSTR4 P31391 2/20 0.63
SSTR5 P35346 2/20 0.63
CACNA1F O60840 2/20 0.63
CACNA1D Q01668 2/20 0.63
CACNA1S Q13698 2/20 0.63
CACNA1C Q13936 2/20 0.63
SSTR1 P30872 2/20 0.63
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL12377679 0.80 SSTR3 (0.71) SSTR3KCNH2SSTR4SSTR5CACNA1F
SCHEMBL12912368 0.80 SSTR3 (0.70) SSTR3KCNH2SSTR4SSTR5CACNA1F
SCHEMBL1714366 0.78 SSTR3 (0.64) SSTR3KCNH2SSTR4SSTR5CACNA1F
SCHEMBL1715602 0.78 SSTR3 (0.64) SSTR3KCNH2SSTR4SSTR5CACNA1F
Fumaric Acid SCHEMBL6714201 0.77 SSTR3 (0.64) SSTR3KCNH2SSTR4SSTR5CACNA1F
Fumaric Acid SCHEMBL6714206 0.77 SSTR3 (0.64) SSTR3KCNH2SSTR4SSTR5CACNA1F
Hydrochloric Acid SCHEMBL6716801 0.74 SSTR3 (0.60) SSTR3KCNH2SSTR4SSTR5CACNA1F
SCHEMBL12890523 0.69 SSTR3 (0.70) SSTR3KCNH2SSTR4SSTR5CACNA1F
SCHEMBL1244095 0.69 SSTR3 (0.70) SSTR3KCNH2SSTR4SSTR5CACNA1F
SCHEMBL13244720 0.66 SSTR3 (0.50) SSTR3KCNH2SSTR4SSTR5CACNA1F

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040038970-A1 Beta-carboline compounds SOCIETE DE CONSEILS DE RECHERCHES ETD' APPLICATION SCIENTIFIQUES, S.A.S. A PARIS, FRANCE CORP. 2004-02-26 US disclosed
US-6586445-B1 Racemic mixtures of 1,2,3,4-tetra hydro-1-(4-methoxyphenyl)-3 -(4-phenyl-1H-imidazol-2-yl)-9H- pyrido(3,4-b)indole, which bind to somatostatin receptors and block sodium channel modulators; antidiabetic, antiinflammatory agents; diarrhea Société de Conseils de Recherches et d'Applications Scientifiques, S.A.S. (FR) 2003-07-01 US disclosed
EP-1086101-B1 BETA-CARBOLINE COMPOUNDS SOD CONSEILS RECH APPLIC (FR) 2002-12-18 EP 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-20040038970-A1 Beta-carboline compounds SCN1B, SCN2B, CACNA1B SSTR3 49/4885KCNH2 78/4885SSTR4 88/4885

“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.