SCHEMBL8480372

SCHEMBL8480372

CC(C)(C)c1ccc(CN2C(=O)N(CC(=O)O)C(=O)[C@]2(C)c2ccc(C=NN)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 5/20 0.35
TP53 P04637 3/20 0.35
CA2 P00918 5/20 0.35
CA1 P00915 3/20 0.34
LMNA P02545 3/20 0.34
HDAC6 Q9UBN7 1/20 0.34
NPC1 O15118 1/20 0.34
KMT2A Q03164 1/20 0.33
RECQL P46063 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
ESRRG P62508 1/20 0.32

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
SCHEMBL8475358 1.00 MDM2 (0.35) MDM2TP53CA2CA1LMNA
Hydrochloric Acid SCHEMBL6701567 0.88 ATM (0.37) MDM2KMT2APTGDR2
SCHEMBL8480629 0.86 AKR1B1 (0.42) MDM2LMNA
SCHEMBL8475817 0.85 AKR1B1 (0.33) KMT2ARECQLPTGDR2
SCHEMBL8475786 0.85 AKR1B1 (0.33) KMT2ARECQLPTGDR2
SCHEMBL8480829 0.83 KMT2A (0.45) KMT2APTGDR2
SCHEMBL8481337 0.83 KMT2A (0.45) KMT2APTGDR2
SCHEMBL8523438 0.83 PTGDR2 (0.36) KMT2APTGDR2
SCHEMBL8480369 0.83 NQO2 (0.39) MDM2TP53HDAC6NPC1KMT2A
SCHEMBL7029703 0.83 NQO2 (0.39) MDM2TP53HDAC6NPC1KMT2A

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
US-5939556-A Hydantoin compounds, salts thereof, processes for their preparation, and processes for preparing pharmaceutically active compounds comprising them HOECHST AKTIENGESELLSCHAFT (DE) 1999-08-17 US disclosed