SCHEMBL12377697

SCHEMBL12377697

Cc1nc([C@H]2N[C@@H](c3nc(-c4ccc(F)cc4)n[nH]3)Cc3c2[nH]c2cc(F)ccc32)no1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SSTR3 P32745 16/20 0.61
KCNH2 Q12809 12/20 0.61
SSTR1 P30872 1/20 0.35
SSTR2 P30874 1/20 0.35
SSTR4 P31391 1/20 0.35
SSTR5 P35346 1/20 0.35
MIF P14174 1/20 0.33
KIT P10721 1/20 0.33
ALOX5 P09917 1/20 0.33
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32

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
SCHEMBL12377698 1.00 SSTR3 (0.61) SSTR3KCNH2SSTR1SSTR2SSTR4
SCHEMBL12377689 0.79 SSTR3 (0.61) SSTR3KCNH2SSTR1SSTR2SSTR4
SCHEMBL12377688 0.79 SSTR3 (0.61) SSTR3KCNH2SSTR1SSTR2SSTR4
SCHEMBL12377684 0.77 SSTR3 (0.84) SSTR3KCNH2
SCHEMBL12377685 0.77 SSTR3 (0.69) SSTR3KCNH2SSTR1HTR2AHTR2C
SCHEMBL12377690 0.77 SSTR3 (0.69) SSTR3KCNH2SSTR1HTR2AHTR2C
SCHEMBL3013321 0.76 SSTR3 (0.73) SSTR3KCNH2SSTR1SSTR2SSTR4
SCHEMBL12377704 0.74 SSTR3 (0.68) SSTR3KCNH2SSTR1SSTR2SSTR4
SCHEMBL12377732 0.73 SSTR3 (0.47) SSTR3KCNH2SSTR1SSTR2SSTR4
SCHEMBL12377703 0.73 SSTR3 (0.47) SSTR3KCNH2SSTR1SSTR2SSTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110201615-A1 TRIAZOLE BETA CARBOLINE DERIVATIVES AS ANTI-DIABETIC AGENTS MERCK SHARP & DOHME CORP. 2011-08-18 US 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-20110201615-A1 TRIAZOLE BETA CARBOLINE DERIVATIVES AS ANTI-DIABETIC AGENTS GPR119, SSTR3, SSTR2 SSTR3 2/4885KCNH2 953/4885SSTR1 10/4885

“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.