SCHEMBL31090043

SCHEMBL31090043

C[C@@H](OCNC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 6/20 0.47
▸ CTSL P07711 1/20 0.46
▸ CTSB P07858 1/20 0.46
▸ CTSS P25774 1/20 0.46
▸ CTSK P43235 1/20 0.46
▸ TGM2 P21980 1/20 0.44
▸ OPRD1 P41143 5/20 0.43
▸ OPRM1 P35372 4/20 0.43
▸ OPRK1 P41145 1/20 0.43

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
SCHEMBL30918204 0.97 CTSB (0.48) PTPN1CTSLCTSBCTSSCTSK
SCHEMBL31089971 0.95 OPRD1 (0.45) PTPN1OPRD1OPRM1OPRK1
SCHEMBL30918202 0.91 PTPN1 (0.45) PTPN1CTSLCTSBCTSSCTSK
SCHEMBL30918284 0.91 PTPN1 (0.45) PTPN1CTSLCTSBCTSSCTSK
SCHEMBL31028496 0.87 OPRD1 (0.45) PTPN1OPRD1OPRM1OPRK1
SCHEMBL31090039 0.87 OPRD1 (0.45) PTPN1OPRD1OPRM1OPRK1
SCHEMBL30918231 0.85 KMT2A (0.47) PTPN1OPRD1
SCHEMBL29101925 0.85 KMT2A (0.47) PTPN1OPRD1
SCHEMBL31089986 0.85 KMT2A (0.47) PTPN1OPRD1
SCHEMBL30712765 0.85 KMT2A (0.47) PTPN1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240293569-A1 LINKER FOR ANTIBODY-DRUG CONJUGATE PINOTBIO, INC. (KR) 2024-09-05 — — 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-20240293569-A1 LINKER FOR ANTIBODY-DRUG CONJUGATE BCR, IGSF11, STT3B PTPN1 3637/4885CTSL 2222/4885CTSB 2477/4885

“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