SCHEMBL19939441

SCHEMBL19939441

CCCCCCC(C)(C)N(C(C)=O)C(C)=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.42
GGPS1 O95749 6/20 0.41
FDPS P14324 9/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LPAR1 Q92633 1/20 0.38
LPAR3 Q9UBY5 1/20 0.38
SMPD1 P17405 1/20 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
SCHEMBL8521468 1.00 CES2 (0.42) CES2GGPS1FDPSMEN1MAPT
SCHEMBL25950632 0.83 CES2 (0.42) CES2GGPS1FDPSMEN1MAPT
SCHEMBL19736033 0.82 CES2 (0.41) CES2GGPS1FDPSMEN1MAPT
SCHEMBL20203168 0.80 CES2 (0.40) CES2GGPS1FDPSMEN1MAPT
SCHEMBL23894886 0.78 CES2 (0.37) CES2GGPS1FDPSMEN1MAPT
SCHEMBL24916372 0.76 MEN1 (0.37) CES2MEN1MAPTKMT2AATM
SCHEMBL23346658 0.74 MEN1 (0.36) CES2GGPS1FDPSMEN1MAPT
SCHEMBL22924889 0.73 CES2 (0.41) CES2GGPS1FDPSMEN1MAPT
SCHEMBL10448099 0.73 CES2 (0.41) CES2GGPS1MEN1KMT2A
SCHEMBL17360709 0.73 CES2 (0.42) CES2GGPS1FDPSMEN1MAPT

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
US-11802123-B2 Heterocyclic compound and organic light emitting device comprising the same LG CHEM, LTD. (KR) 2023-10-31 US disclosed
US-20230043088-A1 Organic Light Emitting Device LG CHEM, LTD. (KR) 2023-02-09 US disclosed
US-20210280794-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2021-09-09 US disclosed
US-11081655-B2 Heterocyclic compound and organic light emitting device using the same LG CHEM, LTD. (KR) 2021-08-03 US disclosed
US-10700289-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2020-06-30 US disclosed
US-10461259-B2 Organic light emitting device LG CHEM, LTD. (KR) 2019-10-29 US disclosed
US-10439153-B2 Compound and organic solar cell comprising same LG CHEM, LTD. (KR) 2019-10-08 US disclosed
US-10355225-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2019-07-16 US disclosed
US-20180114923-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-04-26 US disclosed
US-20180076395-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-15 US disclosed
US-20180069184-A1 COMPOUND AND ORGANIC SOLAR CELL COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-08 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 (10 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-20180114923-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, PER2 CES2 1990/4885GGPS1 536/4885FDPS 1203/4885
US-11802123-B2 Heterocyclic compound and organic light emitting device comprising the same CRY1, CRY2, PPOX CES2 1421/4885GGPS1 65/4885FDPS 110/4885
US-20210280794-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY1, CRY2, AOX1 CES2 760/4885GGPS1 89/4885FDPS 376/4885
US-10461259-B2 Organic light emitting device CRY1, CRY2, MAP1LC3C CES2 576/4885GGPS1 468/4885FDPS 669/4885
US-10439153-B2 Compound and organic solar cell comprising same OR10J3, SUN2, CRY2 CES2 3686/4885GGPS1 1880/4885FDPS 709/4885
US-10355225-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, PER2 CES2 1990/4885GGPS1 536/4885FDPS 1203/4885
US-11081655-B2 Heterocyclic compound and organic light emitting device using the same CRY1, CYP1B1, CYBA CES2 742/4885GGPS1 47/4885FDPS 354/4885
US-20180076395-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, PER2 CES2 1990/4885GGPS1 536/4885FDPS 1203/4885
US-20180069184-A1 COMPOUND AND ORGANIC SOLAR CELL COMPRISING SAME OR10J3, SUN2, CRY2 CES2 3686/4885GGPS1 1880/4885FDPS 709/4885
US-10700289-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, PER2 CES2 1990/4885GGPS1 536/4885FDPS 1203/4885

“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.