SCHEMBL31480424

SCHEMBL31480424

COC(=O)c1ccc(C2CCCCN2)c(NC2CC2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
YAP1 P46937 1/20 0.44
ALOX15 P16050 2/20 0.41
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 1/20 0.41
HDAC8 Q9BY41 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HPGD P15428 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
ATM Q13315 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
XDH P47989 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
NPC1 O15118 1/20 0.38
EPHX2 P34913 1/20 0.38

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
SCHEMBL31480229 0.88 ALDH1A1 (0.42) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL16409252 0.83 SMN1; SMN2 (0.45) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL17782313 0.81 MEN1 (0.42) ALDH1A1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL31480074 0.81 SLC6A3 (0.43) ALDH1A1MEN1KMT2ASMN1; SMN2ATM
SCHEMBL17782315 0.81 MEN1 (0.42) ALDH1A1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL4150927 0.79 MEN1 (0.47) ALOX15ALDH1A1KDM4EMEN1KMT2A
SCHEMBL31480467 0.78 ALDH1A1 (0.35) YAP1ALOX15ALDH1A1KDM4EMEN1
SCHEMBL31480357 0.78 KDM4E (0.51) ALOX15ALDH1A1KDM4EMEN1KMT2A
SCHEMBL31480101 0.78 HPGD (0.56) ALDH1A1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL14194494 0.78 MEN1 (0.46) ALOX15ALDH1A1KDM4EMEN1KMT2A

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
WO-2025054361-A1 COMPLEMENT INHIBITION APELLIS PHARMACEUTICALS, INC. (US) 2025-03-13 WO disclosed