SCHEMBL29522641

SCHEMBL29522641

NC(=O)[C@H](CCCCNC(c1ccccc1)(c1ccccc1)c1ccccc1)N(C(=O)[C@H](Cc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(CO)cc1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 8/20 0.41
▸ GRB2 P62993 1/20 0.36
▸ MDM4 O15151 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36

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
SCHEMBL29522093 0.85 PTPN1 (0.40) PTPN1HDAC1HDAC2
SCHEMBL30518584 0.76 PTPN1 (0.45) PTPN1GRB2
SCHEMBL31614333 0.76 MDM2 (0.53) MDM4TP53
SCHEMBL29400571 0.76 MDM2 (0.53) MDM4TP53
SCHEMBL12527832 0.76 MDM2 (0.53) MDM4TP53
SCHEMBL31212511 0.76 MDM2 (0.50) PTPN1MDM4TP53
SCHEMBL16435194 0.76 MDM2 (0.50) PTPN1MDM4TP53
SCHEMBL17729113 0.75 CASP3 (0.40) PTPN1
SCHEMBL29684642 0.75 CASP3 (0.40) PTPN1
SCHEMBL31681574 0.74 MDM2 (0.45) MDM4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4580754-A1 AN INTEGRIN ALPHA10 ANTIBODY DRUG CONJUGATE Targinta AB (SE) 2025-07-09 — — EP disclosed
WO-2024047172-A1 AN INTEGRIN ALPHA10 ANTIBODY DRUG CONJUGATE TARGINTA AB (SE) 2024-03-07 — — WO disclosed
US-20230398232-A1 Composition and Use of Alternatively Formatted Anti-Mesothelin Antibodies for the Treatment of Cancer Navrogen, Inc. 2023-12-14 — — US disclosed
EP-4217009-A1 COMPOSITION AND USE OF ALTERNATIVELY FORMATTED ANTI-MESOTHELIN ANTIBODIES FOR THE TREATMENT OF CANCER Navrogen, Inc. (US) 2023-08-02 — — EP disclosed
WO-2022067224-A1 COMPOSITION AND USE OF ALTERNATIVELY FORMATTED ANTI-MESOTHELIN ANTIBODIES FOR THE TREATMENT OF CANCER Navrogen, Inc. (US) 2022-03-31 — — WO disclosed
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