SCHEMBL6716256

SCHEMBL6716256

COc1ccc(C2N[C@H](c3nc(-c4ccccc4)c[nH]3)Cc3c2[nH]c2ccccc32)cc1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SSTR3 P32745 8/20 0.69
KCNH2 Q12809 4/20 0.46
HDAC1 Q13547 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
MEN1 O00255 2/20 0.43
ALDH1A1 P00352 2/20 0.43
KMT2A Q03164 2/20 0.43
ALOX12 P18054 1/20 0.43
CCKBR P32239 1/20 0.43
PDE5A O76074 2/20 0.42
CYP2D6 P10635 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
DHODH Q02127 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
SCHEMBL6716252 1.00 SSTR3 (0.69) SSTR3KCNH2HDAC1HDAC6MEN1
SCHEMBL6717600 0.77 SSTR3 (0.65) SSTR3KCNH2CYP2D6
SCHEMBL6717602 0.77 SSTR3 (0.65) SSTR3KCNH2CYP2D6
SCHEMBL1244098 0.77 SSTR3 (0.44) SSTR3KCNH2MEN1ALDH1A1KMT2A
SCHEMBL3002454 0.76 SSTR3 (0.73) SSTR3KCNH2
SCHEMBL6713929 0.74 MAPT (0.50) SSTR3MEN1KMT2APDE5ADHODH
SCHEMBL6713926 0.74 MAPT (0.50) SSTR3MEN1KMT2APDE5ADHODH
SCHEMBL13244716 0.74 SSTR3 (0.69) SSTR3KCNH2
SCHEMBL3010196 0.74 SSTR3 (0.50) SSTR3KCNH2
SCHEMBL13244611 0.73 SSTR3 (0.73) 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 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 78/4885HDAC1 1737/4885

“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.