SCHEMBL26286141

SCHEMBL26286141

CC(C)C1CCN(C(=O)CC2CCCO2)C1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 4/20 0.41
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
TSHR P16473 1/20 0.38
PKM P14618 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KMT2A Q03164 3/20 0.37
CYP3A4 P08684 2/20 0.36
NAMPT P43490 2/20 0.36
MEN1 O00255 2/20 0.35
HTT P42858 1/20 0.35
CYP2C19 P33261 2/20 0.35
CYP2C9 P11712 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
SCHEMBL26286625 1.00 KDM4E (0.41) KDM4EALDH1A1LMNAL3MBTL1TSHR
SCHEMBL22875137 0.92 KDM4E (0.46) KDM4EALDH1A1LMNAL3MBTL1TSHR
SCHEMBL12424283 0.78 ALDH1A1 (0.47) KDM4EALDH1A1LMNAL3MBTL1TSHR
SCHEMBL26287965 0.77 TLR9 (0.38) ALDH1A1NAMPT
SCHEMBL15014609 0.77 ALDH1A1 (0.56) KDM4EALDH1A1LMNAL3MBTL1KMT2A
SCHEMBL24456998 0.77 DPP4 (0.41) ALDH1A1LMNAKMT2AMEN1
SCHEMBL24456643 0.77 DPP4 (0.41) ALDH1A1LMNAKMT2AMEN1
SCHEMBL24456648 0.77 DPP4 (0.41) ALDH1A1LMNAKMT2AMEN1
SCHEMBL13308126 0.76 ALDH1A1 (0.43) KDM4EALDH1A1LMNAL3MBTL1TSHR
SCHEMBL26286132 0.75 RECQL (0.50) KDM4EALDH1A1TSHRPKMHTT

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-2023172737-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF KUMQUAT BIOSCIENCES INC. (US) 2023-09-14 WO disclosed