SCHEMBL29470876

SCHEMBL29470876

COc1ccc(C(NCCCC[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 6/20 0.59
▸ MDM4 O15151 2/20 0.50
▸ TP53 P04637 2/20 0.50
▸ TLR2 O60603 2/20 0.45
▸ KMT2A Q03164 1/20 0.43
▸ CASP3 P42574 1/20 0.42

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
SCHEMBL29379713 1.00 MDM2 (0.59) MDM2MDM4TP53TLR2KMT2A
SCHEMBL19402725 1.00 MDM2 (0.59) MDM2MDM4TP53TLR2KMT2A
SCHEMBL13402819 1.00 MDM2 (0.59) MDM2MDM4TP53TLR2KMT2A
SCHEMBL29414971 1.00 MDM2 (0.59) MDM2MDM4TP53TLR2KMT2A
SCHEMBL29400571 0.93 MDM2 (0.53) MDM2MDM4TP53TLR2KMT2A
SCHEMBL12527832 0.93 MDM2 (0.53) MDM2MDM4TP53TLR2KMT2A
SCHEMBL31614333 0.93 MDM2 (0.53) MDM2MDM4TP53TLR2KMT2A
SCHEMBL6158363 0.91 MDM2 (0.57) MDM2MDM4TP53TLR2KMT2A
SCHEMBL436024 0.91 MDM2 (0.57) MDM2MDM4TP53TLR2KMT2A
SCHEMBL31681399 0.91 MDM2 (0.57) MDM2MDM4TP53TLR2KMT2A

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
CN-116472064-A Antibody-drug conjugates and uses thereof 昆山新蕴达生物科技有限公司 2023-07-21 — — CN claimed
WO-2022078279-A1 ANTIBODY-DRUG CONJUGATE AND USE THEREOF 昆山新蕴达生物科技有限公司 2022-04-21 — — WO claimed
CN-116472064-A Antibody-drug conjugates and uses thereof 昆山新蕴达生物科技有限公司 2023-07-21 — — CN disclosed
WO-2022078279-A1 ANTIBODY-DRUG CONJUGATE AND USE THEREOF 昆山新蕴达生物科技有限公司 2022-04-21 — — WO disclosed
Send feedback