SCHEMBL29634879

SCHEMBL29634879

CCC(CC)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 3/20 0.59
TP53 P04637 3/20 0.59
CASP3 P42574 2/20 0.53
MDM2 Q00987 5/20 0.53
TLR2 O60603 2/20 0.51
KMT2A Q03164 1/20 0.48

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
SCHEMBL22636278 1.00 MDM4 (0.59) MDM4TP53CASP3MDM2TLR2
SCHEMBL22636280 1.00 MDM4 (0.59) MDM4TP53CASP3MDM2TLR2
SCHEMBL30422419 1.00 MDM4 (0.59) MDM4TP53CASP3MDM2TLR2
SCHEMBL29401430 0.93 MDM4 (0.60) MDM4TP53CASP3MDM2TLR2
SCHEMBL29378420 0.93 MDM4 (0.60) MDM4TP53CASP3MDM2TLR2
SCHEMBL118051 0.93 MDM4 (0.60) MDM4TP53CASP3MDM2TLR2
SCHEMBL30353997 0.93 MDM4 (0.60) MDM4TP53CASP3MDM2TLR2
SCHEMBL178787 0.93 MDM4 (0.60) MDM4TP53CASP3MDM2TLR2
SCHEMBL31675022 0.93 MDM4 (0.60) MDM4TP53CASP3MDM2TLR2
SCHEMBL30191581 0.93 MDM4 (0.60) MDM4TP53CASP3MDM2TLR2

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
CN-114585637-B MASP-inhibitory compounds and uses thereof 拜耳公司 2025-04-15 CN disclosed
CN-114585637-A MASP inhibiting compounds and uses thereof 拜耳公司 2022-06-03 CN disclosed