SCHEMBL24601760

SCHEMBL24601760

CC(C)(C)c1cc(-c2cccc3c4c5c6cc(C(F)(F)F)ccc6n6c7c(-c8cc(C(C)(C)C)cc(C(C)(C)C)c8)cccc7c(c7c8cc(C(F)(F)F)ccc8n(c23)c74)c56)cc(C(C)(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.35
KIF11 P52732 3/20 0.35
PARP1 P09874 1/20 0.33
PPARG P37231 2/20 0.31
PPARA Q07869 1/20 0.31
PDE2A O00408 4/20 0.31
PDE10A Q9Y233 3/20 0.31
MAP2K4 P45985 1/20 0.31
ICMT O60725 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HTR1A P08908 1/20 0.31
HTR7 P34969 1/20 0.31
DHODH Q02127 1/20 0.30
PGR P06401 2/20 0.30
NR3C1 P04150 1/20 0.30
NR1H3 Q13133 1/20 0.30
HDAC11 Q96DB2 1/20 0.30
HDAC8 Q9BY41 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
SCHEMBL24601742 0.93 DNMT1 (0.34) KIF11ALDH1A1PGR
SCHEMBL24601559 0.92 ICMT (0.38) EPHX2PARP1ICMTALDH1A1LMNA
SCHEMBL24601558 0.92 ICMT (0.35) EPHX2KIF11ICMTALDH1A1PGR
SCHEMBL24601764 0.91 KIF11 (0.40) EPHX2KIF11PARP1PPARGPPARA
SCHEMBL24601613 0.88 DNMT1 (0.34) KIF11ALDH1A1PGR
SCHEMBL24601577 0.87 SERPINE1 (0.35) KIF11ICMTALDH1A1DHODH
SCHEMBL24601763 0.87 DHODH (0.33) DHODH
SCHEMBL24601585 0.86 RXRB (0.36) KIF11ICMT
SCHEMBL24601664 0.85 TRPA1 (0.41) EPHX2ALDH1A1LMNAPGRNR3C1
SCHEMBL24601470 0.85 RXRA (0.33) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220213113-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUNDS, FLUORESCENCE EMITTERS, ORGANIC ELECTROLUMINESCENT DEVICES, AND MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SAMSUNG ELECTRONICS CO., LTD. (KR) 2022-07-07 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 (1 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-20220213113-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUNDS, FLUORESCENCE EMITTERS, ORGANIC ELECTROLUMINESCENT DEVICES, AND MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES NCL, NOC2L, NOLC1 EPHX2 3041/4885KIF11 3347/4885PARP1 1114/4885

“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.