SCHEMBL30845852

SCHEMBL30845852

O=C1c2ccccc2C(=O)C1CC1CO1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.45
S100A4 P26447 2/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
DHFR P00374 1/20 0.40
CYP1A2 P05177 2/20 0.38
TP53 P04637 2/20 0.38
LMNA P02545 2/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
HTR2B P41595 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAOB P27338 1/20 0.37
PIM1 P11309 1/20 0.36
CYP19A1 P11511 2/20 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
SCHEMBL12458500 1.00 MEN1 (0.45) MEN1KMT2APOLBS100A4ALDH1A1
SCHEMBL18053325 1.00 MEN1 (0.45) MEN1KMT2APOLBS100A4ALDH1A1
SCHEMBL7915228 0.72 MEN1 (0.48) MEN1KMT2APOLBS100A4ALDH1A1
SCHEMBL21208080 0.68 CRBN (0.58) ALDH1A1CYP1A2TDP1
SCHEMBL86112 0.67 KMT2A (0.48) MEN1KMT2APOLBS100A4ALDH1A1
SCHEMBL10287951 0.67 MEN1 (0.48) MEN1KMT2APOLBS100A4ALDH1A1
SCHEMBL8365427 0.67 ALDH1A1 (0.58) MEN1KMT2APOLBS100A4ALDH1A1
Anthraquinone SCHEMBL14723446 0.67 TDP1 (0.48) MEN1KMT2APOLBS100A4ALDH1A1
SCHEMBL78821 0.67 CYP2C9 (0.68) MEN1KMT2AALDH1A1MAPTDHFR
SCHEMBL38819 0.67 CYP2C9 (0.68) MEN1KMT2AALDH1A1MAPTDHFR

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-111542523-B Heterocyclic compounds as PRMT5 inhibitors 朱比连特埃皮斯科瑞有限责任公司 2024-03-29 CN disclosed