SCHEMBL24601636

SCHEMBL24601636

CC(C)(C)c1cc(-c2ccc3c(c2)c2c4c5cc(-c6c(-c7ccccc7)cccc6-c6ccccc6)ccc5n5c6ccc(-c7cc(C(C)(C)C)cc(C(C)(C)C)c7)cc6c(c6c7cc(-c8c(-c9ccccc9)cccc8-c8ccccc8)ccc7n3c26)c45)cc(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRB P28702 7/20 0.40
RXRA P19793 6/20 0.40
SERPINE1 P05121 3/20 0.35
RXRG P48443 3/20 0.34
KIF11 P52732 1/20 0.32
CNR1 P21554 1/20 0.32
NR1H4 Q96RI1 1/20 0.31
GPR84 Q9NQS5 1/20 0.31
TSPO P30536 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
SCHEMBL24601809 0.95 RXRB (0.37) RXRBRXRASERPINE1RXRG
SCHEMBL24601638 0.95 RXRB (0.37) RXRBRXRASERPINE1RXRG
SCHEMBL24601805 0.92 RXRB (0.39) RXRBRXRASERPINE1RXRGKIF11
SCHEMBL24601495 0.89 TSPO (0.30) RXRBRXRATSPO
SCHEMBL24601482 0.87 SERPINE1 (0.34) RXRBRXRASERPINE1KIF11NR1H4
SCHEMBL24601643 0.87 DNMT1 (0.36) RXRBRXRASERPINE1KIF11NR1H4
SCHEMBL24601687 0.85 RXRB (0.40) RXRBRXRASERPINE1RXRGKIF11
SCHEMBL24601787 0.85 GPR84 (0.34) SERPINE1NR1H4GPR84TSPO
SCHEMBL24601565 0.85 DNMT1 (0.36) SERPINE1KIF11GPR84
SCHEMBL26261789 0.85 RXRB (0.33) RXRBRXRARXRGTSPO

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 4654/4885SERPINE1 4819/4885

“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.