SCHEMBL2684874

SCHEMBL2684874

CN(c1cscn1)C(Cc1ccc(F)cc1)C(=O)N1CCc2c(C(=O)O)cc(-c3ccncc3)cc21

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR142 Q7Z601 4/20 0.33
CYP17A1 P05093 1/20 0.31
CYP21A2 P08686 1/20 0.31
CYP11B1 P15538 1/20 0.31
OPRL1 P41146 1/20 0.30
MC4R P32245 1/20 0.30
MC3R P41968 1/20 0.30
MC1R Q01726 1/20 0.30
AKT1 P31749 1/20 0.30

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 0.93 GPR142 (0.38) GPR142
SCHEMBL2684711 0.88 PPARG (0.34) GPR142CYP17A1CYP21A2CYP11B1MC4R
SCHEMBL2684935 0.87 GPR142 (0.35) GPR142
SCHEMBL2685742 0.86 AKT1 (0.33) GPR142CYP17A1CYP21A2CYP11B1AKT1
SCHEMBL2685710 0.85 GPR142 (0.36) GPR142
SCHEMBL2686021 0.84 GPR142 (0.35) GPR142
SCHEMBL2684730 0.82 GPR142 (0.34) GPR142
SCHEMBL2684240 0.82 GPR142 (0.35) GPR142
SCHEMBL2684876 0.81 GPR142 (0.48) GPR142
SCHEMBL2684110 0.80 GPR142 (0.33) 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 2779/4885CYP17A1 820/4885CYP21A2 354/4885

“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.