SCHEMBL29325641

SCHEMBL29325641

COC(=O)c1ccc(C2CNCCN2)cc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 2/20 0.36
GLA P06280 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
ATM Q13315 1/20 0.36
HSD17B10 Q99714 1/20 0.36
FUCA1 P04066 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
CA12 O43570 1/20 0.35

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
SCHEMBL31056427 1.00 CTSL (0.38) CTSLCTSBCTSSCTSKMEN1
SCHEMBL29320338 0.87 CA12 (0.48) CTSLCTSBCTSSCTSKMEN1
SCHEMBL29325561 0.86 CTSL (0.40) CTSLCTSBCTSSCTSKMEN1
SCHEMBL29321284 0.86 ALDH1A1 (0.48) CTSLCTSBCTSSCTSKMEN1
SCHEMBL31056902 0.86 CTSL (0.40) CTSLCTSBCTSSCTSKMEN1
SCHEMBL29320158 0.85 CTSL (0.39) CTSLCTSBCTSSCTSKMEN1
SCHEMBL25076845 0.82 KDM4E (0.47) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL30988614 0.82 KDM4E (0.47) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL31386223 0.77 TAAR1 (0.50)
SCHEMBL9786097 0.77 HTR2A (0.37) CTSLCTSBCTSSCTSKSLC6A2

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
WO-2024148274-A1 COMPLEMENT INHIBITION APELLIS PHARMACEUTICALS, INC. (US) 2024-07-11 WO disclosed
WO-2024148274-A1 COMPLEMENT INHIBITION APELLIS PHARMACEUTICALS, INC. (US) 2024-07-11 WO disclosed