SCHEMBL31688511

SCHEMBL31688511

O=C(N[C@@H](Cc1ccc(OCc2ccccn2)cc1)C(=O)O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR132 Q9UNW8 1/20 0.53
ITGB3 P05106 9/20 0.49
ITGA2B P08514 9/20 0.49
MDM4 O15151 2/20 0.49
TP53 P04637 2/20 0.49
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
MAOB P27338 1/20 0.46
ITGAV P06756 1/20 0.46
MDM2 Q00987 1/20 0.46
PTPN1 P18031 1/20 0.45

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
SCHEMBL7339224 0.89 PTPN1 (0.46) GPR132MDM4TP53HDAC1HDAC2
SCHEMBL7339216 0.89 PTPN1 (0.46) GPR132MDM4TP53HDAC1HDAC2
SCHEMBL29401723 0.88 ITGB3 (0.57) ITGB3ITGA2BITGAVPTPN1
SCHEMBL2305323 0.88 ITGB3 (0.57) ITGB3ITGA2BITGAVPTPN1
SCHEMBL29908019 0.88 ITGB3 (0.57) ITGB3ITGA2BITGAVPTPN1
SCHEMBL2305316 0.88 ITGB3 (0.57) ITGB3ITGA2BITGAVPTPN1
SCHEMBL119886 0.88 ITGB3 (0.57) ITGB3ITGA2BITGAVPTPN1
SCHEMBL29401248 0.88 ITGB3 (0.57) ITGB3ITGA2BITGAVPTPN1
SCHEMBL31694964 0.87 MDM4 (0.56) MDM4TP53HDAC1HDAC2MDM2
SCHEMBL3725839 0.87 MDM4 (0.56) MDM4TP53HDAC1HDAC2MDM2

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-20250296915-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2025-09-25 US claimed
US-20250296915-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2025-09-25 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-20250296915-A1 NOVEL AMINO ACID DERIVATIVES DNPEP, BCAT1, ANPEP GPR132 2451/4885ITGB3 3500/4885ITGA2B 2865/4885

“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.