SCHEMBL30704249

SCHEMBL30704249

CC(Cc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 4/20 0.54
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 2/20 0.51
MDM4 O15151 1/20 0.48
TP53 P04637 1/20 0.48
EPHX2 P34913 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
SCHEMBL19622257 1.00 CASP3 (0.54) CASP3NPC1RAB9AKMT2AMDM4
SCHEMBL2949021 0.92 CASP3 (0.49) CASP3KMT2AMDM4TP53EPHX2
SCHEMBL11948879 0.92 CASP3 (0.49) CASP3NPC1RAB9AKMT2AMDM4
SCHEMBL21895853 0.88 SMN1; SMN2 (0.52) CASP3NPC1RAB9AKMT2A
SCHEMBL23918186 0.87 CASP3 (0.45) CASP3KMT2AMDM4TP53EPHX2
SCHEMBL25968838 0.87 KMT2A (0.50) CASP3KMT2AEPHX2
SCHEMBL23463335 0.87 TLR2 (0.46) CASP3KMT2A
SCHEMBL15317905 0.86 CASP3 (0.51) CASP3KMT2AMDM4TP53EPHX2
SCHEMBL24141044 0.86 KMT2A (0.48) CASP3NPC1RAB9AKMT2A
SCHEMBL7391100 0.86 CASP3 (0.64) CASP3KMT2AMDM4TP53EPHX2

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
US-20250090554-A1 A METHOD OF TREATING DEPRESSION BY IMMUNE MODULATION MYND LIFE SCIENCES INC (CA) 2025-03-20 US disclosed
CN-117342974-A Novel azide derivative reagent for chiral analysis and preparation and application thereof 武汉大学 2024-01-05 CN disclosed