SCHEMBL22757206

SCHEMBL22757206

CCC(=O)[C@@H](OCNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CCCCCN1C(=O)CC(C(C)C)C1=O)C1CC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 6/20 0.39
ACE P12821 3/20 0.38
ACE2 Q9BYF1 3/20 0.38
HRH1 P35367 2/20 0.37
OPRD1 P41143 2/20 0.36
OPRK1 P41145 2/20 0.36
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL24342160 0.93 OPRL1 (0.40) OPRL1ACEACE2HRH1OPRD1
SCHEMBL24342121 0.93 OPRL1 (0.41) OPRL1HRH1OPRD1OPRK1ALDH1A1
SCHEMBL24342159 0.93 OPRL1 (0.41) OPRL1HRH1OPRD1OPRK1ALDH1A1
SCHEMBL26458009 0.90 OPRL1 (0.39) OPRL1ACEACE2OPRK1ALDH1A1
SCHEMBL24342162 0.90 OPRL1 (0.39) OPRL1ACEACE2OPRD1OPRK1
SCHEMBL25764635 0.87 OPRL1 (0.42) OPRL1ACEACE2OPRD1ALDH1A1
SCHEMBL25881766 0.87 OPRL1 (0.42) OPRL1ACEACE2OPRD1ALDH1A1
SCHEMBL27268254 0.86 OPRL1 (0.43) OPRL1OPRD1OPRK1ALDH1A1SMN1; SMN2
SCHEMBL23680330 0.85 OPRL1 (0.40) OPRL1HRH1OPRD1OPRK1ALDH1A1
SCHEMBL21916127 0.85 OPRL1 (0.40) OPRL1HRH1OPRD1OPRK1ALDH1A1

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-20230140397-A1 ANTI-PSMA ANTIBODY-EXATECAN ANALOGUE CONJUGATE AND MEDICAL USE THEREOF JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2023-05-04 US disclosed
WO-2020244657-A1 ANTI-B7-H4 ANTIBODY–DRUG CONJUGATE AND MEDICINAL USE THEREOF 上海翰森生物医药科技有限公司 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 (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-20230140397-A1 ANTI-PSMA ANTIBODY-EXATECAN ANALOGUE CONJUGATE AND MEDICAL USE THEREOF FOLH1, ENPEP, PEPD OPRL1 1346/4885ACE 948/4885ACE2 1663/4885

“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.