SCHEMBL31336587

SCHEMBL31336587

Clc1ccc(-c2cccc3oc4c(-c5ccccc5)cccc4c23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.46
CYP1A2 P05177 1/20 0.42
PRKDC P78527 3/20 0.42
PIK3CD O00329 1/20 0.41
TNKS O95271 1/20 0.41
AHR P35869 2/20 0.41
CDC14B O60729 2/20 0.40
CDC14A Q9UNH5 2/20 0.40
RET P07949 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C8 P10632 1/20 0.39
CYP2C9 P11712 1/20 0.39
DHODH Q02127 1/20 0.39
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL31336558 0.88 ALOX5 (0.47) ALOX5CYP1A2PRKDCPIK3CDAHR
SCHEMBL23824049 0.88 ALOX5 (0.47) ALOX5CYP1A2PRKDCPIK3CDAHR
SCHEMBL25748062 0.87 PRKDC (0.40) ALOX5CYP1A2PRKDCPIK3CDAHR
SCHEMBL23046710 0.87 ALOX5 (0.52) ALOX5PRKDCPIK3CDTNKSAHR
SCHEMBL23046730 0.87 ALOX5 (0.52) ALOX5PRKDCPIK3CDTNKSAHR
SCHEMBL22007460 0.86 ALOX5 (0.47) ALOX5CYP1A2PRKDCPIK3CDAHR
SCHEMBL15470445 0.85 ALOX5 (0.60) ALOX5PRKDCPIK3CDTNKSAHR
SCHEMBL29597498 0.85 ALOX5 (0.60) ALOX5PRKDCPIK3CDTNKSAHR
SCHEMBL24969341 0.85 CYP1A2 (0.50) ALOX5CYP1A2PRKDCPIK3CDTNKS
SCHEMBL31336505 0.85 CYP1A2 (0.50) ALOX5CYP1A2PRKDCPIK3CDTNKS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119547588-A Pellet for organic electroluminescent element and organic electroluminescent element using same 索路思高新材料有限公司 2025-02-28 CN disclosed
CN-119422471-A Composition for organic electroluminescent element and organic electroluminescent element comprising same 索路思高新材料有限公司 2025-02-11 CN disclosed