SCHEMBL19940308

SCHEMBL19940308

Cc1ccc(-c2ccc3c(ccn3C(CCC3CCC3)c3ccc(C(=O)O)cc3)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GCGR P47871 6/20 0.45
ADRB3 P13945 1/20 0.39
P2RY14 Q15391 2/20 0.36
DGAT1 O75907 1/20 0.35
KDM2B Q8NHM5 1/20 0.35
PTGER4 P35408 2/20 0.35
ICMT O60725 1/20 0.35
PTGER3 P43115 1/20 0.35
PTGER2 P43116 1/20 0.35
PPARG P37231 1/20 0.35
RARA P10276 1/20 0.34
RARB P10826 1/20 0.34
RARG P13631 1/20 0.34
RAPGEF4 Q8WZA2 1/20 0.34
MAP4K4 O95819 1/20 0.34

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
SCHEMBL19940307 0.90 GCGR (0.43) GCGRADRB3DGAT1
SCHEMBL19922897 0.89 GCGR (0.55) GCGRADRB3P2RY14
SCHEMBL19940306 0.87 GCGR (0.63) GCGR
SCHEMBL19940309 0.83 GCGR (0.52) GCGR
SCHEMBL19940302 0.82 GCGR (0.45) GCGRICMTRARARARB
SCHEMBL19923020 0.81 GCGR (0.54) GCGRADRB3
SCHEMBL19922880 0.78 GCGR (0.73) GCGR
SCHEMBL19922909 0.76 GCGR (0.61) GCGR
SCHEMBL19922788 0.76 GCGR (0.61) GCGRP2RY14
SCHEMBL19922851 0.76 GCGR (0.72) GCGR

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-10251864-B2 Indole derivatives useful as glucagon receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2019-04-09 US disclosed
US-20180064686-A1 INDOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2018-03-08 US disclosed
US-20180064686-A1 INDOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2018-03-08 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 (2 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-10251864-B2 Indole derivatives useful as glucagon receptor antagonists GPR119, GIPR, GLP1R GCGR 4/4885ADRB3 70/4885P2RY14 1249/4885
US-20180064686-A1 INDOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS GPR119, GIPR, GLP1R GCGR 4/4885ADRB3 70/4885P2RY14 1249/4885

“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.