SCHEMBL25853291

SCHEMBL25853291

CC1(c2ccccc2)c2ccccc2Oc2cccc(-c3cccc4c3C(C)(c3ccccc3)c3ccccc3-4)c21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.33
GOPC Q9HD26 1/20 0.33
AHR P35869 1/20 0.33
ATM Q13315 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
NPSR1 Q6W5P4 3/20 0.31
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 2/20 0.31
CYP2C9 P11712 2/20 0.31
CYP2C19 P33261 2/20 0.31
HTT P42858 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PDK2 Q15119 1/20 0.30
PLIN1 O60240 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL15713397 0.81 MMP2 (0.41) CFTRGOPCAHRMMP2MMP9
SCHEMBL23861584 0.75 ALOX5 (0.39) AHRMMP2MMP9
SCHEMBL5887516 0.75 MMP2 (0.45) CFTRGOPCATMKDM4EMMP2
SCHEMBL31312579 0.75 MMP2 (0.45) CFTRGOPCATMKDM4EMMP2
SCHEMBL18466613 0.73 MMP2 (0.35) CFTRGOPCATMKDM4EMMP2
SCHEMBL19847531 0.73 MAPT (0.39) CFTRGOPCKDM4EMMP2MMP9
SCHEMBL23028838 0.72 LMNA (0.39) CFTRGOPCAHRATMKDM4E
SCHEMBL23861422 0.71 LPL (0.38) MAPK1MMP2MMP9ALDH1A1
SCHEMBL14026073 0.71 MMP2 (0.44) CFTRGOPCATMMMP2MMP9
SCHEMBL23861425 0.71 ALOX5 (0.35) AHRMMP2MMP9

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
WO-2023120714-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-06-29 WO disclosed