SCHEMBL19313618

SCHEMBL19313618

CCC(CC)(c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc4ccccc34)n2)cc1)c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc4ccccc34)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 2/20 0.43
ENPP3 O14638 1/20 0.43
S1PR1 P21453 1/20 0.40
S1PR3 Q99500 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
ALDH1A1 P00352 5/20 0.40
MAPT P10636 5/20 0.40
HPGD P15428 5/20 0.40
KDM4E B2RXH2 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
NFKB1 P19838 1/20 0.40
MAPK1 P28482 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
ATM Q13315 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL19483244 0.95 MEN1 (0.40) ENPP1ENPP3S1PR1S1PR3PPARG
SCHEMBL17725012 0.93 ENPP1 (0.38) ENPP1ENPP3S1PR1S1PR3PPARG
SCHEMBL17725653 0.92 MEN1 (0.42) ENPP1ENPP3PPARGPPARAALDH1A1
SCHEMBL17725014 0.92 MEN1 (0.42) ENPP1ENPP3PPARGPPARAALDH1A1
SCHEMBL17725646 0.89 SMN1; SMN2 (0.44) ENPP1ENPP3S1PR1S1PR3PPARG
SCHEMBL19313853 0.84 PPARG (0.47) ENPP1ENPP3PPARGPPARAALDH1A1
SCHEMBL17725005 0.83 MEN1 (0.54) ALDH1A1MAPTHPGDKDM4ETDP1
SCHEMBL17725644 0.83 MEN1 (0.54) ALDH1A1MAPTHPGDKDM4ETDP1
SCHEMBL10051315 0.83 ALDH1A1 (0.50) ENPP1ENPP3ALDH1A1MAPTHPGD
SCHEMBL18732401 0.83 MAPT (0.53) ENPP1ENPP3ALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3389108-B1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEMICAL LTD (KR) 2023-09-13 EP disclosed
US-11723268-B2 Organic light-emitting element LG CHEM, LTD. 2023-08-08 US disclosed
US-11723268-B2 Organic light-emitting element LG CHEM, LTD. 2023-08-08 US disclosed
EP-3388496-B1 ORGANIC LIGHT-EMITTING ELEMENT COMPRISING DIBENZOFURAN-ANTHRACENE DERIVATIVE IN LIGHT EMITTING LAYER AND DIPHENYLMETHYL DERIVATIVE IN ELECTRON INJECTION LAYER LG CHEMICAL LTD (KR) 2021-02-24 EP disclosed
US-20200136053-A1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-04-30 US disclosed
EP-3214084-B1 CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEMICAL LTD (KR) 2020-02-19 EP disclosed
US-10431748-B2 Cyclic compound and organic light-emitting element comprising same LG CHEM, LTD. (KR) 2019-10-01 US disclosed
US-20190019961-A1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEM, LTD. (KR) 2019-01-17 US disclosed
US-20170301866-A1 CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2017-10-19 US disclosed
US-20170301866-A1 CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2017-10-19 US disclosed
EP-3214084-A2 CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG Chem, Ltd. (KR) 2017-09-06 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170301866-A1 CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, PER2 ENPP1 1521/4885ENPP3 1858/4885S1PR1 4739/4885
US-11723268-B2 Organic light-emitting element CRY2, NR2E3, CRY1 ENPP1 1656/4885ENPP3 1560/4885S1PR1 4864/4885
US-10431748-B2 Cyclic compound and organic light-emitting element comprising same CRY1, CRY2, PER2 ENPP1 1521/4885ENPP3 1858/4885S1PR1 4739/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.