SCHEMBL19940304

SCHEMBL19940304

CC(F)(F)CCC(c1ccc(C(=O)O)cc1)n1ccc2cc(-c3ccc(C(F)(F)F)cc3)ccc21

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GCGR P47871 9/20 0.59
SLC6A2 P23975 1/20 0.40
P2RY14 Q15391 1/20 0.40
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
PTGER4 P35408 2/20 0.38
PTGDR Q13258 2/20 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
SCHEMBL19922864 0.90 GCGR (0.57) GCGRSLC6A2P2RY14RXRARXRB
SCHEMBL19922788 0.90 GCGR (0.61) GCGRSLC6A2P2RY14RXRARXRB
SCHEMBL19922907 0.89 GCGR (0.65) GCGRSLC6A2P2RY14RXRARXRB
SCHEMBL19922853 0.88 GCGR (0.59) GCGRSLC6A2P2RY14
SCHEMBL19922870 0.87 GCGR (0.58) GCGRSLC6A2P2RY14
SCHEMBL19922897 0.84 GCGR (0.55) GCGRSLC6A2P2RY14RXRARXRB
SCHEMBL19970067 0.79 GCGR (0.70) GCGR
SCHEMBL19922844 0.79 GCGR (0.76) GCGR
SCHEMBL19922820 0.78 GCGR (0.81) GCGR
SCHEMBL19922783 0.78 GCGR (0.77) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20180064686-A1 INDOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS GPR119, GIPR, GLP1R GCGR 4/4885SLC6A2 738/4885P2RY14 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.