SCHEMBL22199401

SCHEMBL22199401

CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 4/20 0.50
▸ CTSL P07711 4/20 0.50
▸ CTSB P07858 2/20 0.50
▸ CTSK P43235 2/20 0.49
▸ MMP1 P03956 1/20 0.48
▸ FCER2 P06734 1/20 0.48
▸ ACE P12821 2/20 0.47
▸ MME P08473 4/20 0.46
▸ OPRD1 P41143 2/20 0.46
▸ MMP3 P08254 1/20 0.46
▸ MMP9 P14780 1/20 0.46
▸ MMP8 P22894 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ OPRM1 P35372 1/20 0.46
▸ OPRK1 P41145 1/20 0.46

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
SCHEMBL12126308 0.88 ACE (0.55) CTSSCTSLCTSBCTSKACE
SCHEMBL12126314 0.88 ACE (0.60) CTSSCTSLCTSBCTSKACE
SCHEMBL22927776 0.87 CTSS (0.67) CTSSCTSLCTSBCTSKMMP1
SCHEMBL22695725 0.86 CTSS (0.54) CTSSCTSLCTSBCTSKACE
SCHEMBL16656682 0.86 CTSS (0.54) CTSSCTSLCTSBCTSKACE
SCHEMBL25976737 0.86 CTSS (0.55) CTSSCTSLCTSBCTSKMMP1
SCHEMBL30881100 0.86 CTSS (0.52) CTSSCTSLCTSBCTSKACE
SCHEMBL9388987 0.85 CTSS (0.49) CTSSCTSLCTSBCTSKACE
SCHEMBL9388996 0.85 CTSS (0.49) CTSSCTSLCTSBCTSKACE
SCHEMBL18752348 0.85 MMP1 (0.46) CTSSCTSLCTSBCTSKMMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023006084-A1 ANTI-DLL3 ANTIBODY AND PREPARATION METHOD THEREFOR, DRUG CONJUGATE AND APPLICATION THEREOF 上海复旦张江生物医药股份有限公司 2023-02-02 — — WO disclosed
WO-2020254613-A1 CONTROLLED-RELEASE TYROSINE KINASE INHIBITOR COMPOUNDS WITH LOCALIZED PK PROPERTIES Ascendis Pharma Oncology Division A/S (DK) 2020-12-24 — — WO disclosed
WO-2020254611-A1 ANTI-CTLA4 CONJUGATES Ascendis Pharma Oncology Division A/S (DK) 2020-12-24 — — WO disclosed
WO-2020254617-A1 ANTI-CTLA4 COMPOUNDS WITH LOCALIZED PK PROPERTIES Ascendis Pharma Oncology Division A/S (DK) 2020-12-24 — — WO disclosed
WO-2020254609-A1 TYROSINE KINASE INHIBITOR CONJUGATES Ascendis Pharma Oncology Division A/S (DK) 2020-12-24 — — WO disclosed
WO-2020141225-A1 MINIMIZATION OF SYSTEMIC INFLAMMATION ASCENDIS PHARMA A/S (DK) 2020-07-09 — — WO disclosed
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