SCHEMBL2687844

SCHEMBL2687844

CN(c1cn(C)cn1)[C@@H](Cc1ccccc1)C(=O)Nc1nnc(-c2ccncc2)s1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GPR142 Q7Z601 3/20 0.51
▸ NOX1 Q9Y5S8 11/20 0.50
▸ KDM4E B2RXH2 5/20 0.45
▸ ALDH1A1 P00352 4/20 0.45
▸ HPGD P15428 3/20 0.45
▸ MAPT P10636 1/20 0.44
▸ GAA P10253 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ RCE1 Q9Y256 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL2685860 0.85 GPR142 (0.62) GPR142NOX1KDM4EALDH1A1HPGD
SCHEMBL2685524 0.82 GPR142 (0.50) GPR142NOX1KDM4EALDH1A1HPGD
SCHEMBL2687848 0.80 GPR142 (0.71) GPR142NOX1
SCHEMBL2687851 0.80 GPR142 (0.71) GPR142NOX1
SCHEMBL2686192 0.77 NOX1 (0.55) GPR142NOX1KDM4EALDH1A1HPGD
SCHEMBL2685412 0.75 GPR142 (0.51) GPR142NOX1KDM4EALDH1A1HPGD
SCHEMBL2685334 0.74 GPR142 (0.60) GPR142NOX1KDM4EALDH1A1HPGD
SCHEMBL2685328 0.74 GPR142 (0.60) GPR142NOX1KDM4EALDH1A1HPGD
SCHEMBL2684254 0.73 GPR142 (0.67) GPR142NOX1KDM4EALDH1A1HPGD
SCHEMBL2685591 0.71 GPR142 (0.57) GPR142NOX1

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 2 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 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 2779/4885NOX1 2943/4885KDM4E 3283/4885

“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.

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