SCHEMBL29100540

SCHEMBL29100540

c1ccc2c(c1)oc1cccc([C]3CCCCC3)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
KDM4E B2RXH2 6/20 0.40
HPGD P15428 4/20 0.40
CASP1 P29466 2/20 0.40
HSD17B10 Q99714 2/20 0.40
MAOA P21397 3/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GLA P06280 2/20 0.39
CYP3A4 P08684 1/20 0.39
PGAM1 P18669 1/20 0.39
CASP7 P55210 1/20 0.39
ALOX5 P09917 2/20 0.37
CDC14B O60729 1/20 0.37
CDC14A Q9UNH5 1/20 0.37
BACE1 P56817 1/20 0.35
AHR P35869 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL29100537 1.00 ALDH1A1 (0.40) ALDH1A1KDM4EHPGDCASP1HSD17B10
SCHEMBL28665769 0.98 KDM4E (0.41) ALDH1A1KDM4EHPGDCASP1HSD17B10
SCHEMBL29100520 0.95 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDCASP1HSD17B10
SCHEMBL29100519 0.91 HPGD (0.43) ALDH1A1KDM4EHPGDCASP1HSD17B10
SCHEMBL30550556 0.80 ALDH1A1 (0.52) ALDH1A1KDM4EHPGDCASP1HSD17B10
SCHEMBL3081231 0.80 ALDH1A1 (0.52) ALDH1A1KDM4EHPGDCASP1HSD17B10
SCHEMBL29222550 0.79 ELANE (0.44) ALDH1A1KDM4EHPGDCASP1HSD17B10
SCHEMBL16670035 0.78 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDCASP1HSD17B10
SCHEMBL22141302 0.75 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDCASP1HSD17B10
SCHEMBL20363781 0.75 HPGD (0.46) ALDH1A1KDM4EHPGDCASP1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118139509-A Organic electroluminescent device 长春海谱润斯科技股份有限公司 2024-06-04 CN disclosed
CN-117924268-A Heterocyclic compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2024-04-26 CN disclosed
CN-117903188-A Heterocyclic compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2024-04-19 CN disclosed
CN-117903189-A Carbazole compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2024-04-19 CN disclosed
CN-117886804-A Compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2024-04-16 CN disclosed
CN-117567500-A Aromatic amine compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2024-02-20 CN disclosed
CN-117534576-A Aromatic amine compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2024-02-09 CN disclosed
CN-117384119-A Aromatic amine compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2024-01-12 CN disclosed
CN-117384120-A Fluorene-containing triarylamine compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2024-01-12 CN disclosed
CN-117229309-A Triarylamine compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2023-12-15 CN disclosed
CN-117164574-A Nitrogen-containing condensed aromatic ring compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2023-12-05 CN disclosed
CN-117126149-A Heterocyclic compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2023-11-28 CN disclosed
CN-117088900-A Carbazole compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2023-11-21 CN disclosed
CN-117088907-A Carbazole compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2023-11-21 CN disclosed
CN-117088889-A Carbazole compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2023-11-21 CN disclosed
CN-117003716-A Triarylamine derivative based on fluorenyl heterocycle and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2023-11-07 CN disclosed