SCHEMBL5960068

SCHEMBL5960068

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cncc(-c2ccnn2C2CCCCO2)c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 1/20 0.44
▸ SCN9A Q15858 7/20 0.43
▸ CCKAR P32238 2/20 0.43
▸ CCKBR P32239 2/20 0.43
▸ ACE P12821 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ CTSS P25774 4/20 0.42
▸ CTSK P43235 3/20 0.42
▸ CTSB P07858 2/20 0.42
▸ CTSL P07711 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ REN P00797 1/20 0.40

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
SCHEMBL5960870 0.78 SCN9A (0.46) SCN9ACCKARCCKBRACEREN
SCHEMBL2683577 0.74 HDAC8 (0.57) NTRK1CCKARCCKBRACEHDAC8
SCHEMBL2683575 0.74 HDAC8 (0.57) NTRK1CCKARCCKBRACEHDAC8
SCHEMBL31129946 0.71 ATR (0.47) L3MBTL1
SCHEMBL3944495 0.70 HDAC8 (0.72) ACEHDAC8CTSSCTSKCTSB
SCHEMBL9610766 0.70 HDAC8 (0.72) ACEHDAC8CTSSCTSKCTSB
SCHEMBL6853498 0.70 NTRK1 (0.47) NTRK1SCN9ACCKARCCKBRACE
SCHEMBL6853500 0.70 NTRK1 (0.47) NTRK1SCN9ACCKARCCKBRACE
SCHEMBL23357008 0.70 ACE (0.41) ACECTSSCTSKCTSB
SCHEMBL23357006 0.70 ACE (0.41) ACECTSSCTSKCTSB

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 5 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-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
US-20120115811-A1 PHENYLANALINE AMIDE DERIVATIVES USEFUL FOR TREATING INSULIN-RELATED DISEASES AND CONDITIONS AMGEN INC. (US) 2012-05-10 — — US disclosed
WO-2010093849-A2 PHENYLALANINE AMIDE DERIVATIVES USEFUL FOR TREATING INSULIN-RELATED DISEASES AND CONDITIONS AMGEN INC. (US) 2010-08-19 — — WO 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 NTRK1 4439/4885SCN9A 2166/4885CCKAR 288/4885

“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.

Send feedback