SCHEMBL17829381

SCHEMBL17829381

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5ccc(-c6cccc7cccnc67)cc5)c5ccccc45)cc3)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 2/20 0.44
KDM4E B2RXH2 2/20 0.44
TP53 P04637 2/20 0.44
MAPT P10636 2/20 0.44
TSHR P16473 2/20 0.44
NFKB1 P19838 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
LMNA P02545 2/20 0.44
GMNN O75496 1/20 0.44
HSP90AA1 P07900 1/20 0.44
MMP2 P08253 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
ALOX15 P16050 1/20 0.44
MMP8 P22894 1/20 0.44
CCR1 P32246 1/20 0.44
THPO P40225 1/20 0.44
MTOR P42345 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL17829362 0.98 TSHR (0.46) MMP9KDM4ETP53MAPTTSHR
SCHEMBL21131637 0.97 CKS1B (0.42) MMP9KDM4ETP53MAPTTSHR
SCHEMBL21131830 0.95 KDM4E (0.43) MMP9KDM4ETP53MAPTTSHR
SCHEMBL24315267 0.94 KDM4E (0.46) MMP9KDM4ETP53MAPTTSHR
SCHEMBL12580374 0.94 MMP2 (0.50) MMP9KDM4ETP53MAPTTSHR
SCHEMBL12580425 0.94 MMP2 (0.50) MMP9KDM4ETP53MAPTTSHR
SCHEMBL19166596 0.93 CKS1B (0.40) MMP9KDM4ETP53MAPTTSHR
SCHEMBL12580384 0.92 KDM4E (0.46) MMP9KDM4ETP53MAPTTSHR
SCHEMBL12580439 0.92 KDM4E (0.46) MMP9KDM4ETP53MAPTTSHR
SCHEMBL12580382 0.92 MMP2 (0.48) MMP9KDM4ETP53MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11737357-B2 Compound and organic light-emitting device comprising same LG CHEM, LTD. 2023-08-22 US disclosed
US-11737357-B2 Compound and organic light-emitting device comprising same LG CHEM, LTD. 2023-08-22 US disclosed
US-20230255104-A1 Compound And Organic Light-Emitting Device Comprising Same LG CHEM, LTD. (KR) 2023-08-10 US disclosed
US-20230255104-A1 Compound And Organic Light-Emitting Device Comprising Same LG CHEM, LTD. (KR) 2023-08-10 US disclosed
EP-3351537-B1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEMICAL LTD (KR) 2023-01-18 EP disclosed
US-11211563-B2 Organic light emitting device LG CHEM, LTD. (KR) 2021-12-28 US disclosed
US-20190198766-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2019-06-27 US disclosed
US-20190055222-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2019-02-21 US disclosed
EP-3351537-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG Chem, Ltd. (KR) 2018-07-25 EP disclosed
WO-2017074053-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2017-05-04 WO disclosed
US-9502669-B2 Organic light emitting diode LG CHEM, LTD. (KR) 2016-11-22 US disclosed
US-9502669-B2 Organic light emitting diode LG CHEM, LTD. (KR) 2016-11-22 US disclosed
US-20160293852-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2016-10-06 US disclosed
US-20160293852-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2016-10-06 US disclosed
US-20160172598-A1 HETERO RING COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2016-06-16 US disclosed
US-20160172598-A1 HETERO RING COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2016-06-16 US 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 (4 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-11737357-B2 Compound and organic light-emitting device comprising same CRY1, CYP1B1, CYP1A1 MMP9 2665/4885KDM4E 3410/4885TP53 4242/4885
US-20230255104-A1 Compound And Organic Light-Emitting Device Comprising Same ARL1, AR, ALG3 MMP9 3995/4885KDM4E 3327/4885TP53 3372/4885
US-20160172598-A1 HETERO RING COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME CRY1, CRY2, PER2 MMP9 3689/4885KDM4E 1590/4885TP53 2330/4885
US-20190055222-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, CYP1B1, CYP1A1 MMP9 2665/4885KDM4E 3410/4885TP53 4242/4885

“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.