SCHEMBL24601541

SCHEMBL24601541

CC(C)(C)c1ccc(-c2cccc3c2c2c4c5ccccc5n5c6ccccc6c(c6c7ccccc7n3c62)c45)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 3/20 0.36
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
GPR84 Q9NQS5 1/20 0.34
RET P07949 1/20 0.34
MAPK1 P28482 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
PMM2 O15305 1/20 0.33
MPI P34949 1/20 0.33
PHOSPHO1 Q8TCT1 1/20 0.33
TNKS O95271 2/20 0.33
TNKS2 Q9H2K2 2/20 0.33
S1PR1 P21453 1/20 0.33
PARP1 P09874 1/20 0.32

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
SCHEMBL24601602 1.00 NR1H4 (0.36) NR1H4ALDH1A1MAPTNPSR1GPR84
SCHEMBL24601420 0.89 NR1H4 (0.36) NR1H4ALDH1A1MAPTNPSR1GPR84
SCHEMBL24601416 0.88 RXRA (0.32)
SCHEMBL24601614 0.88 RXRA (0.32)
SCHEMBL21718335 0.85 NR1H4 (0.39) NR1H4ALDH1A1MAPTNPSR1GPR84
SCHEMBL24601589 0.84 HSD17B10 (0.36) ALDH1A1MAPTRETKDM4EMEN1
SCHEMBL24601777 0.80 DHODH (0.33) NR1H4ALDH1A1MAPTNPSR1GPR84
SCHEMBL24601457 0.80 TSPO (0.38) ALDH1A1MAPTNPSR1MAPK1KDM4E
SCHEMBL24601540 0.80 ALDH1A1 (0.37) ALDH1A1MAPTNPSR1GPR84MAPK1
SCHEMBL24601344 0.80 ALDH1A1 (0.37) ALDH1A1MAPTNPSR1GPR84MAPK1

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 NR1H4 4783/4885ALDH1A1 3824/4885MAPT 1370/4885

“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.