SCHEMBL2684935

SCHEMBL2684935

CN(c1cscn1)[C@@H](Cc1ccccc1)C(=O)N1CCc2c(C(N)=O)cc(-c3ccncc3)cc21

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR142 Q7Z601 9/20 0.35
GPR52 Q9Y2T5 3/20 0.34
CDC7 O00311 3/20 0.34
IKBKB O14920 2/20 0.34
CHUK O15111 1/20 0.34
IKBKE Q14164 1/20 0.34
PKMYT1 Q99640 1/20 0.34
ROCK2 O75116 1/20 0.34
MAP4K4 O95819 1/20 0.34
GSK3B P49841 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
MKNK2 Q9HBH9 1/20 0.34
CDK9 P50750 1/20 0.34
EIF2AK3 Q9NZJ5 1/20 0.33
CCNC P24863 1/20 0.33
CDK8 P49336 1/20 0.33
PIK3R2 O00459 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
SCHEMBL2686226 0.94 GPR142 (0.38) GPR142EIF2AK3
SCHEMBL2685710 0.91 GPR142 (0.36) GPR142GPR52ROCK2GSK3BCLK4
SCHEMBL2684730 0.91 GPR142 (0.34) GPR142ROCK2GSK3BCLK4
SCHEMBL2686021 0.89 GPR142 (0.35) GPR142ROCK2GSK3BCLK4
SCHEMBL2684240 0.88 GPR142 (0.35) GPR142GSK3BCLK4CDK9EIF2AK3
SCHEMBL2684874 0.87 GPR142 (0.33) GPR142
SCHEMBL2686380 0.84 GPR142 (0.33) GPR142
SCHEMBL2685567 0.83 GPR52 (0.39) GPR142GPR52
SCHEMBL2686363 0.83 CACNA2D1 (0.34) GPR142EIF2AK3
SCHEMBL2684887 0.83 GPR142 (0.34) GPR142

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-8785468-B2 Phenylalanine amide derivatives useful for treating insulin-related diseases and conditions AMGEN INC. (US) 2014-07-22 US claimed
US-8785468-B2 Phenylalanine amide derivatives useful for treating insulin-related diseases and conditions AMGEN INC. (US) 2014-07-22 US disclosed
US-20120115811-A1 PHENYLANALINE AMIDE DERIVATIVES USEFUL FOR TREATING INSULIN-RELATED DISEASES AND CONDITIONS AMGEN INC. (US) 2012-05-10 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-20120115811-A1 PHENYLANALINE AMIDE DERIVATIVES USEFUL FOR TREATING INSULIN-RELATED DISEASES AND CONDITIONS IAPP, INSR, AMY2A GPR142 2779/4885GPR52 855/4885CDC7 4432/4885

“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.