SCHEMBL24601604

SCHEMBL24601604

CC(C)(C)c1cc(-c2ccc3c4c5c6ccc(-c7cccc8oc9ccccc9c78)cc6n6c7cc(-c8cc(C(C)(C)C)cc(C(C)(C)C)c8)ccc7c(c7c8ccc(-c9cccc%10oc%11ccccc%11c9%10)cc8n(c3c2)c47)c56)cc(C(C)(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
MAPT P10636 1/20 0.34
ALOX5 P09917 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
BACE1 P56817 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
RXFP1 Q9HBX9 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
SCHEMBL24601601 0.96 ALDH1A1 (0.32) ALDH1A1MAPTALOX5NPSR1RXFP1
SCHEMBL24601328 0.96 ALDH1A1 (0.32) ALDH1A1MAPTALOX5NPSR1RXFP1
SCHEMBL24601324 0.91 ALDH1A1 (0.34) ALDH1A1MAPTALOX5RXRARXRB
SCHEMBL24601793 0.89 ALDH1A1 (0.36) ALDH1A1MAPTALOX5
SCHEMBL24601797 0.89 ALDH1A1 (0.36) ALDH1A1MAPTALOX5
SCHEMBL22178726 0.85 ALOX5 (0.38) ALDH1A1MAPTALOX5BACE1
SCHEMBL26270336 0.84 ALDH1A1 (0.43) ALDH1A1MAPTALOX5RXRARXRB
SCHEMBL24601410 0.83 ALOX5 (0.36) ALDH1A1MAPTALOX5BACE1NPSR1
SCHEMBL24601417 0.82 RXRB (0.36) ALDH1A1MAPTRXRARXRBNPSR1
SCHEMBL24601345 0.82 RXRB (0.36) ALDH1A1MAPTRXRARXRBNPSR1

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 ALDH1A1 3824/4885MAPT 1370/4885ALOX5 2351/4885

“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.