SCHEMBL24601502

SCHEMBL24601502

CC(C)(C)c1cc(-c2ccc3c4c5c6cc(C(C)(C)c7ccccc7)ccc6n6c7cc(-c8cc(C(C)(C)C)cc(C(C)(C)C)c8)ccc7c(c7c8cc(C(C)(C)c9ccccc9)ccc8n(c3c2)c74)c56)cc(C(C)(C)C)c1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRB P28702 6/20 0.33
RXRA P19793 5/20 0.33
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 0.33
RXRG P48443 2/20 0.33
SERPINE1 P05121 2/20 0.32
CNR1 P21554 2/20 0.32
CNR2 P34972 2/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL24601516 0.94 RXRB (0.35) RXRBRXRAESR1ESR2RXRG
SCHEMBL24601782 0.92 RXRB (0.34) RXRBRXRARXRGSERPINE1
SCHEMBL24601425 0.92 RXRA (0.35) RXRBRXRAESR1ESR2SERPINE1
SCHEMBL24601618 0.91 SERPINE1 (0.34) RXRBRXRAESR1ESR2RXRG
SCHEMBL24601401 0.91 SERPINE1 (0.37) RXRBRXRASERPINE1CNR1CNR2
SCHEMBL24601405 0.90 CNR1 (0.36) RXRBRXRAESR1ESR2SERPINE1
SCHEMBL24601617 0.89 PGR (0.35) RXRBRXRARXRGSERPINE1CNR1
SCHEMBL24601441 0.89 HTR1D (0.35) RXRBRXRARXRGSERPINE1
SCHEMBL24601483 0.86 RXRB (0.36) RXRBRXRARXRGSERPINE1
SCHEMBL24601400 0.86 ESR1 (0.39) ESR1ESR2CNR1CNR2ALDH1A1

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 RXRB 4748/4885RXRA 4654/4885ESR1 1037/4885

“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.