SCHEMBL21157808

SCHEMBL21157808

CC(C)(C)c1cc(-c2ccccc2-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)c2oc3c(-c4ccccc4-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)cc(C(C)(C)C)cc3c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
NPC1 O15118 1/20 0.35
PLA2G1B P04054 1/20 0.35
NFKB1 P19838 1/20 0.35
CASP3 P42574 1/20 0.35
RAB9A P51151 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
RXRA P19793 5/20 0.34
RXRB P28702 5/20 0.34
RXRG P48443 3/20 0.33
DHODH Q02127 1/20 0.32
PRKDC P78527 2/20 0.32
S1PR1 P21453 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
SCHEMBL21157073 1.00 ALDH1A1 (0.36) ALDH1A1MAPTNPC1PLA2G1BNFKB1
SCHEMBL21157902 0.87 ALDH1A1 (0.45) ALDH1A1MAPTNPC1PLA2G1BNFKB1
SCHEMBL21156615 0.82 ABCG2 (0.40) ALDH1A1MAPTNPC1PLA2G1BNFKB1
SCHEMBL21157066 0.82 ABCG2 (0.40) ALDH1A1MAPTNPC1PLA2G1BNFKB1
SCHEMBL21157814 0.80 NUDT1 (0.40) ALDH1A1MAPTNPC1RAB9APRKDC
SCHEMBL21157071 0.80 NUDT1 (0.40) ALDH1A1MAPTNPC1RAB9APRKDC
SCHEMBL21157898 0.79 ALDH1A1 (0.35) ALDH1A1MAPTNPC1PLA2G1BNFKB1
SCHEMBL21156613 0.79 ALDH1A1 (0.35) ALDH1A1MAPTNPC1PLA2G1BNFKB1
SCHEMBL21157227 0.78 ALDH1A1 (0.34) ALDH1A1MAPTNPC1PLA2G1BNFKB1
SCHEMBL26050716 0.76 ALOX5 (0.50) ALDH1A1MAPTRXRARXRBPRKDC

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-20190214577-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, POLYMER, MIXTURE, FORMULATION, AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-07-11 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-20190214577-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, POLYMER, MIXTURE, FORMULATION, AND ORGANIC ELECTRONIC DEVICE TEAD2, TEAD3, TEAD1 ALDH1A1 1545/4885MAPT 148/4885NPC1 4818/4885

“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.