SCHEMBL29068247

SCHEMBL29068247

CCc1cc(-c2ccccc2)cc(CC)c1CC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.44
PTPN1 P18031 2/20 0.43
PTPN2 P17706 1/20 0.43
PTPN6 P29350 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.41
POLB P06746 1/20 0.41
RECQL P46063 1/20 0.41
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPT P10636 2/20 0.41
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40
DCLRE1A Q6PJP8 1/20 0.39
DCLRE1B Q9H816 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 2/20 0.38

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
SCHEMBL509517 0.82 PTGS1 (0.58) PTGS1PTPN1PTPN2PTPN6SMN1; SMN2
SCHEMBL28608991 0.82 PTGS1 (0.53) PTGS1PTPN1PTPN2PTPN6SMN1; SMN2
SCHEMBL1023740 0.80 PTPN1 (0.55) PTGS1PTPN1PTPN2PTPN6SMN1; SMN2
SCHEMBL7617883 0.80 GABRA1 (0.54) PTGS1PTPN1PTPN2PTPN6SMN1; SMN2
SCHEMBL7615550 0.80 POLB (0.44) PTGS1PTPN1PTPN2PTPN6SMN1; SMN2
SCHEMBL31549864 0.78 SMN1; SMN2 (0.41) PTGS1SMN1; SMN2POLBRECQLALDH1A1
SCHEMBL30380433 0.77 DCLRE1A (0.47) PTGS1SMN1; SMN2ALDH1A1L3MBTL1MAPT
SCHEMBL28992451 0.77 DCLRE1A (0.47) PTGS1SMN1; SMN2ALDH1A1L3MBTL1MAPT
SCHEMBL27694339 0.77 PTGS1 (0.49) PTGS1PTPN1PTPN2PTPN6SMN1; SMN2
SCHEMBL4529436 0.77 SMN1; SMN2 (0.38) PTGS1SMN1; SMN2POLBRECQLL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117296468-A Composition for organic electroluminescent element, display device, and lighting device 三菱化学株式会社 2023-12-26 CN disclosed
CN-116670252-A Composition for organic electroluminescent element, display device, and lighting device 三菱化学株式会社 2023-08-29 CN disclosed
WO-2022234763-A1 COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND ILLUMINATOR 三菱ケミカル株式会社 2022-11-10 WO disclosed
WO-2022149519-A1 COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND ILLUMINATOR 三菱ケミカル株式会社 2022-07-14 WO disclosed