SCHEMBL2685653

SCHEMBL2685653

O=C(O)C[C@@H](Cc1ccccc1)C(=O)F

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 3/20 0.72
CPA3 P15088 3/20 0.72
CPB1 P15086 1/20 0.72
CPB2 Q96IY4 1/20 0.72
LTA4H P09960 2/20 0.59
CYP1A2 P05177 1/20 0.59
MMP2 P08253 1/20 0.54
MMP9 P14780 1/20 0.54
MMP12 P39900 1/20 0.54
FOLH1 Q04609 1/20 0.52
MMEL1 Q495T6 1/20 0.51

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
SCHEMBL393002 0.84 CPA1 (1.00) CPA1CPA3CPB1CPB2LTA4H
SCHEMBL1915564 0.84 CPA1 (1.00) CPA1CPA3CPB1CPB2LTA4H
SCHEMBL5688996 0.84 CPA1 (1.00) CPA1CPA3CPB1CPB2LTA4H
SCHEMBL3421012 0.82 CPA1 (0.96) CPA1CPA3CPB1CPB2LTA4H
SCHEMBL11248580 0.81 CPA3 (0.72) CPA1CPA3CPB1CPB2LTA4H
SCHEMBL27663350 0.81 CPA1 (0.72) CPA1CPA3CPB1CPB2LTA4H
SCHEMBL7540835 0.81 CPA1 (0.72) CPA1CPA3CPB1CPB2LTA4H
SCHEMBL638640 0.79 CPA1 (0.70) CPA1CPA3CPB1CPB2LTA4H
Succinic Acid SCHEMBL28290802 0.79 CPA1 (0.89) CPA1CPA3CPB1CPB2LTA4H
SCHEMBL3842528 0.79 CPA1 (0.64) CPA1CPA3CPB1CPB2LTA4H

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 CPA1 696/4885CPA3 2189/4885CPB1 848/4885

“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.