SCHEMBL31511366

SCHEMBL31511366

COC(=O)c1ccc2c(c1)CCC2OC1CCCCO1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
NPC1 O15118 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
NAMPT P43490 1/20 0.39
HSD11B1 P28845 2/20 0.38
CHRNB2 P17787 1/20 0.38
CHRNA4 P43681 1/20 0.38
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPSR1 Q6W5P4 2/20 0.37
ATM Q13315 1/20 0.37
POLB P06746 2/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
HNF4A P41235 1/20 0.36
CFTR P13569 1/20 0.36

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
SCHEMBL31511358 1.00 ALDH1A1 (0.40) ALDH1A1NPC1HPGDRAB9ANAMPT
SCHEMBL8481056 0.77 HSD11B1 (0.39) HSD11B1
SCHEMBL8481807 0.76 HSD11B1 (0.35) ALDH1A1HPGDHSD11B1KMT2AMEN1
SCHEMBL30789930 0.76 HSD11B1 (0.35) ALDH1A1HPGDHSD11B1KMT2AMEN1
SCHEMBL31511367 0.76 HSD11B1 (0.37) NAMPTHSD11B1KMT2AMEN1
SCHEMBL7381225 0.74 KMT2A (0.40) ALDH1A1NPC1HPGDRAB9ANAMPT
SCHEMBL6994885 0.73 IDO1 (0.50)
SCHEMBL14968941 0.72 FFAR1 (0.44) ALDH1A1HPGDRAB9ACHRNB2CHRNA4
SCHEMBL25621200 0.72 HPGD (0.47) ALDH1A1NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL31511361 0.72 CHRNB2 (0.48) ALDH1A1NPC1HPGDRAB9AHSD11B1

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
CN-119497713-A USP1 inhibitors 上海齐鲁制药研究中心有限公司 2025-02-21 CN disclosed