SCHEMBL30968778

SCHEMBL30968778

CC(C)(C)CC1NC(C(=O)O)C(c2ccccc2F)C1c1ccc(Cl)cc1F

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 19/20 0.40
MDM4 O15151 4/20 0.40
TP53 P04637 2/20 0.36
GPBAR1 Q8TDU6 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
SCHEMBL30968811 0.94 MDM2 (0.41) MDM2MDM4TP53
SCHEMBL30006755 0.94 MDM2 (0.40) MDM2MDM4TP53
SCHEMBL30005629 0.92 MDM2 (0.37) MDM2MDM4TP53GPBAR1
SCHEMBL30006461 0.91 MDM2 (0.42) MDM2MDM4TP53
SCHEMBL3373614 0.91 MDM2 (0.45) MDM2MDM4TP53
SCHEMBL30492739 0.91 MDM2 (0.45) MDM2MDM4TP53
SCHEMBL3373608 0.91 MDM2 (0.45) MDM2MDM4TP53
SCHEMBL30007161 0.90 MDM2 (0.36) MDM2MDM4TP53
SCHEMBL30007129 0.88 MDM2 (0.40) MDM2MDM4TP53GPBAR1
SCHEMBL30005686 0.88 MDM2 (0.40) MDM2MDM4TP53

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
CN-118047784-A Small molecule compound with substituted phenyl spiro [ indoline-3, 3' -pyrrolidine ] structure 中国科学院上海药物研究所 2024-05-17 CN disclosed