SCHEMBL20172843

SCHEMBL20172843

CN(c1ccccc1OC(F)(F)F)c1cccc2c1oc1c(C(F)(F)F)cccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.36
SLC6A4 P31645 2/20 0.32
S1PR1 P21453 2/20 0.32
KDM4E B2RXH2 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MAPT P10636 1/20 0.32
ALDH1A1 P00352 1/20 0.32
C1R P00736 1/20 0.31
EPHX2 P34913 1/20 0.31
ACP1 P24666 1/20 0.31
RPS6KA2 Q15349 1/20 0.31
CNR2 P34972 1/20 0.31
ADRA2A P08913 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30
SCN9A Q15858 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A3 Q01959 1/20 0.30
HTR6 P50406 1/20 0.30
SLC22A12 Q96S37 1/20 0.30

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
SCHEMBL20172834 0.91 HTR6 (0.32) HSD11B1L3MBTL1ALDH1A1C1REPHX2
SCHEMBL20172808 0.86 L3MBTL1 (0.32) SLC6A4KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL20172815 0.86 S1PR1 (0.33) SLC6A4S1PR1KDM4EL3MBTL1MAPT
SCHEMBL20172837 0.85 ACP1 (0.35) KDM4EC1REPHX2ACP1
SCHEMBL20650497 0.85 HSD11B1 (0.34) HSD11B1SLC6A4S1PR1KDM4EL3MBTL1
SCHEMBL20172792 0.85 MAOA (0.39) SLC6A4KDM4EL3MBTL1MAPTALDH1A1
SCHEMBL20172864 0.84 EPHX2 (0.33) KDM4EL3MBTL1MAPTALDH1A1C1R
SCHEMBL21020437 0.83 SLC6A3 (0.36) SLC6A4KDM4EL3MBTL1ALDH1A1C1R
SCHEMBL21020270 0.83 KCNK3 (0.39) L3MBTL1ALDH1A1C1REPHX2RPS6KA2
SCHEMBL20172820 0.82 ALDH1A1 (0.35) KDM4EL3MBTL1MAPTALDH1A1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10651411-B2 Compound and organic light emitting device containing same LG CHEM, LTD. (KR) 2020-05-12 US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 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 (2 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-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME CRY1, CRY2, OR10J3 HSD11B1 1717/4885SLC6A4 3332/4885S1PR1 4425/4885
US-10651411-B2 Compound and organic light emitting device containing same CRY1, CRY2, OR10J3 HSD11B1 1717/4885SLC6A4 3332/4885S1PR1 4425/4885

“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.