SCHEMBL22749409

SCHEMBL22749409

CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(N)=O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 5/20 0.52
OPRM1 P35372 4/20 0.52
OPRK1 P41145 1/20 0.52
FCER2 P06734 2/20 0.51
MMP1 P03956 1/20 0.51
HPGDS O60760 3/20 0.50
CTSS P25774 2/20 0.50
CTSK P43235 1/20 0.50
ALDH1A1 P00352 1/20 0.48
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
MTNR1A P48039 1/20 0.48
MTNR1B P49286 1/20 0.48

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
SCHEMBL22749410 1.00 OPRD1 (0.52) OPRD1OPRM1OPRK1FCER2MMP1
SCHEMBL11191380 0.88 ACE (0.56) CTSSCTSK
SCHEMBL11191376 0.88 ACE (0.56) CTSSCTSK
SCHEMBL19889377 0.88 HPGDS (0.46) OPRD1OPRM1OPRK1FCER2MMP1
SCHEMBL9419204 0.86 OPRD1 (0.61) OPRD1OPRM1OPRK1FCER2MMP1
SCHEMBL20646451 0.86 FCER2 (0.49) OPRD1OPRM1OPRK1FCER2MMP1
SCHEMBL9419209 0.86 OPRD1 (0.61) OPRD1OPRM1OPRK1FCER2MMP1
SCHEMBL15003956 0.86 QRFPR (0.56) FCER2MMP1HPGDS
SCHEMBL17177755 0.86 QRFPR (0.56) FCER2MMP1HPGDS
SCHEMBL16602248 0.85 HDAC3 (0.55) FCER2MMP1HPGDSCTSSALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12625144-B2 Chemoselective sensitivity booster for tagging a peptide, peptide conjugate, or similar reactive molecule Indian Institute Of Science Education And Research Bhopal (IN) 2026-05-12 US disclosed
US-20220299521-A1 CHEMOSELECTIVE SENSITIVITY BOOSTER FOR TAGGING A PEPTIDE, PEPTIDE CONJUGATE, OR SIMILAR REACTIVE MOLECULE Indian Institute Of Science Education And Research Bhopal (IN) 2022-09-22 US disclosed
WO-2020245843-A1 CHEMOSELECTIVE SENSITIVITY BOOSTER FOR TAGGING A PEPTIDE, PEPTIDE CONJUGATE, OR SIMILAR REACTIVE MOLECULE Indian Institute Of Science Education And Research Bhopal (IN) 2020-12-10 WO disclosed
WO-2020245843-A1 CHEMOSELECTIVE SENSITIVITY BOOSTER FOR TAGGING A PEPTIDE, PEPTIDE CONJUGATE, OR SIMILAR REACTIVE MOLECULE Indian Institute Of Science Education And Research Bhopal (IN) 2020-12-10 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 (2 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-20220299521-A1 CHEMOSELECTIVE SENSITIVITY BOOSTER FOR TAGGING A PEPTIDE, PEPTIDE CONJUGATE, OR SIMILAR REACTIVE MOLECULE PTMS, PA2G4, MAX OPRD1 4377/4885OPRM1 4396/4885OPRK1 4673/4885
US-12625144-B2 Chemoselective sensitivity booster for tagging a peptide, peptide conjugate, or similar reactive molecule DPYSL3, CD2BP2, PTMS OPRD1 2716/4885OPRM1 919/4885OPRK1 2867/4885

“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.