SCHEMBL24601439

SCHEMBL24601439

CC(C)(C)c1cccc(C(C)(C)C)c1-c1cccc2c3c4c5ccccc5n5c6c(-c7c(C(C)(C)C)cccc7C(C)(C)C)cccc6c(c6c7ccccc7n(c12)c63)c45

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.33
RORC P51449 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
CA2 P00918 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
PRKDC P78527 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
SCHEMBL24601434 0.90 PRKDC (0.35) KIF11RORCKDM4EMAPTCA2
SCHEMBL24601438 0.80 ALKBH5 (0.41) KDM4EMAPTALDH1A1TDP1
SCHEMBL24601826 0.77 KIF11 (0.32) KIF11
SCHEMBL24601470 0.77 RXRA (0.33) ALDH1A1
SCHEMBL24601420 0.77 NR1H4 (0.36) KDM4EMAPTALDH1A1
SCHEMBL24601445 0.77 HSD17B10 (0.34) KDM4EMAPTALDH1A1TSHRTDP1
SCHEMBL24601421 0.76 RXRA (0.32) RORC
SCHEMBL24601825 0.74 TRPA1 (0.40) RORCPRKDC
SCHEMBL24601745 0.73 KIF11 (0.38) KIF11KDM4EMAPTALDH1A1
SCHEMBL25490851 0.73 ALKBH5 (0.42) KIF11KDM4EMAPTCA2ALDH1A1

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 KIF11 3347/4885RORC 3561/4885KDM4E 3163/4885

“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.