SCHEMBL30135893

SCHEMBL30135893

CCCCOC(=O)Nc1ccc(CC2CCNCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.53
NPC1 O15118 7/20 0.53
SMN1; SMN2 Q16637 6/20 0.53
HPGD P15428 4/20 0.53
MAPT P10636 3/20 0.53
ALDH1A1 P00352 2/20 0.53
CASP1 P29466 1/20 0.53
KDM4E B2RXH2 1/20 0.53
MAPK1 P28482 1/20 0.53
MCL1 Q07820 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
KMT2A Q03164 2/20 0.51
TP53 P04637 1/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
LMNA P02545 1/20 0.45

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
SCHEMBL10156681 0.83 NPC1 (0.55) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL23783312 0.80 GBA1 (0.56) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL30136036 0.79 CYP17A1 (0.49) MAPTKMT2ALMNAGAA
SCHEMBL7564852 0.79 RAB9A (0.79) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL31043657 0.79 CHRM2 (0.48)
SCHEMBL6162059 0.78 GBA1 (0.51) SMN1; SMN2MAPTALDH1A1KDM4E
Hydrochloric Acid SCHEMBL31029085 0.78 CHRM2 (0.47)
SCHEMBL1022959 0.78 RAB9A (0.68) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL12012737 0.78 CHRM3 (0.53) RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL29892760 0.76 RAB9A (0.67) RAB9ANPC1SMN1; SMN2HPGDMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4384520-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND Uppthera, Inc. (KR) 2024-06-19 EP disclosed
WO-2023017442-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 WO disclosed
WO-2023017446-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 WO disclosed