SCHEMBL31540147

SCHEMBL31540147

CCCCc1c2ccccc2c(OB(O)O)c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.40
ALDH1A1 P00352 5/20 0.40
HPGD P15428 5/20 0.40
HSD17B10 Q99714 4/20 0.40
NCEH1 Q6PIU2 1/20 0.39
LIPG Q9Y5X9 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 2/20 0.36
RAD52 P43351 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
PCSK9 Q8NBP7 1/20 0.36
CFTR P13569 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 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
SCHEMBL4887109 0.80 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10NCEH1
SCHEMBL29611102 0.80 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10NCEH1
SCHEMBL23404631 0.77 LIPG (0.44) KDM4EALDH1A1HPGDHSD17B10NCEH1
SCHEMBL10488804 0.77 LTA4H (0.43) KDM4EALDH1A1HPGDHSD17B10NCEH1
SCHEMBL10530656 0.74 KDM4E (0.46) KDM4EALDH1A1HPGDHSD17B10NCEH1
SCHEMBL5555781 0.74 LIPG (0.47) KDM4EALDH1A1HSD17B10LIPGLMNA
SCHEMBL11577551 0.74 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10NCEH1
SCHEMBL250349 0.73 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10LIPG
SCHEMBL30127786 0.73 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10LIPG
SCHEMBL28275474 0.73 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10NCEH1

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-112979597-B Heterocyclic compound and organic light-emitting device including the same 三星电子株式会社 2025-05-13 CN disclosed