SCHEMBL5548865

SCHEMBL5548865

C(=Cc1ccc2cc3cc(C=Cc4ccccc4)ccc3cc2c1)c1ccccc1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.83
PLG P00747 1/20 0.59
PLAU P00749 1/20 0.59
PLAT P00750 1/20 0.59
KLK1 P06870 1/20 0.59
ALDH1A1 P00352 1/20 0.55
GLA P06280 1/20 0.55
MAPT P10636 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
PTGS1 P23219 1/20 0.53
NFE2L2 Q16236 2/20 0.50
CYP19A1 P11511 2/20 0.50
MAOA P21397 2/20 0.50
MAOB P27338 2/20 0.50
NQO2 P16083 2/20 0.50
TRPA1 O75762 1/20 0.50
CYP1A1 P04798 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP1B1 Q16678 1/20 0.48
PDGFRB P09619 1/20 0.47

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
SCHEMBL5548861 1.00 RELA (0.83) RELAPLGPLAUPLATKLK1
SCHEMBL5406016 0.98 RELA (0.87) RELAPLGPLAUPLATKLK1
SCHEMBL5406013 0.98 RELA (0.87) RELAPLGPLAUPLATKLK1
SCHEMBL5406009 0.98 RELA (0.87) RELAPLGPLAUPLATKLK1
SCHEMBL11209385 0.95 RELA (0.91) RELAPLGPLAUPLATKLK1
SCHEMBL11268864 0.95 RELA (0.91) RELAPLGPLAUPLATKLK1
SCHEMBL9166695 0.93 RELA (0.86) RELAPLGPLAUPLATKLK1
SCHEMBL9166699 0.93 RELA (0.86) RELAPLGPLAUPLATKLK1
SCHEMBL5407847 0.91 RELA (1.00) RELAPLGPLAUPLATKLK1
SCHEMBL5407848 0.91 RELA (1.00) RELAPLGPLAUPLATKLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116770422-A Method and device for growing high-quality low-defect molecular crystal 中国科学院化学研究所 2023-09-19 CN claimed
CN-110752296-B Method for preparing top contact source and drain electrodes in OFET (organic field effect transistor) by solution method 中国科学院化学研究所 2022-02-25 CN claimed
CN-110854268-B Method for eliminating photoresponse of organic field effect transistor 中国科学院化学研究所 2021-06-22 CN claimed
CN-110854268-A Method for eliminating photoresponse of organic field effect transistor 中国科学院化学研究所 2020-02-28 CN claimed
CN-110752296-A Method for preparing top contact source and drain electrodes in OFET (organic field effect transistor) by solution method 中国科学院化学研究所 2020-02-04 CN claimed
CN-119193144-A Maser and preparation method thereof 华南理工大学 2024-12-27 CN disclosed
CN-116770422-A Method and device for growing high-quality low-defect molecular crystal 中国科学院化学研究所 2023-09-19 CN disclosed
CN-110854268-B Method for eliminating photoresponse of organic field effect transistor 中国科学院化学研究所 2021-06-22 CN disclosed
CN-110854268-A Method for eliminating photoresponse of organic field effect transistor 中国科学院化学研究所 2020-02-28 CN disclosed
EP-1781675-B1 PHOSPHONATE FLUORESCENT DYES AND CONJUGATES EPOCH BIOSCIENCES INC (US) 2014-03-26 EP disclosed
EP-1869720-A2 ARYL-ETHYLENE SUBSTITUTED AROMATIC COMPOUNDS AND THEIR USE AS ORGANIC SEMICONDUCTORS E.I.Du pont de nemours and company (US) 2007-12-26 EP disclosed
WO-2006113205-A2 ARYL-ETHYLENE SUBSTITUTED AROMATIC COMPOUNDS AND THEIR USE AS ORGANIC SEMICONDUCTORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2006-10-26 WO disclosed