SCHEMBL24673724

SCHEMBL24673724

CC(C)(C)c1nc2ccccc2n1-c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccccc4)ccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.40
ESR2 Q92731 3/20 0.40
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
CNR2 P34972 1/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
SLC22A12 Q96S37 2/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
HSP90AA1 P07900 1/20 0.35
ADORA2A P29274 1/20 0.35
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
GRIA1 P42261 1/20 0.34
CACNG8 Q8WXS5 1/20 0.34
CACNG2 Q9Y698 1/20 0.34
PDE10A Q9Y233 3/20 0.34

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
SCHEMBL24674133 1.00 ESR1 (0.40) ESR1ESR2MAPK1HTTCNR2
SCHEMBL24674274 1.00 ESR1 (0.40) ESR1ESR2MAPK1HTTCNR2
SCHEMBL24674410 0.94 ESR1 (0.36) ESR1ESR2MAPK1HTTCNR2
SCHEMBL12912477 0.89 CNR2 (0.41) ESR1ESR2MAPK1HTTCNR2
SCHEMBL26370462 0.88 ESR1 (0.40) ESR1ESR2MAPK1HTTMAPT
SCHEMBL20286689 0.86 MAPK1 (0.50) ESR1ESR2MAPK1HTTCNR2
SCHEMBL14499562 0.85 CNR2 (0.40) ESR1ESR2MAPK1HTTCNR2
SCHEMBL25752088 0.84 ESR1 (0.50) ESR1ESR2MAPK1HTTMAPT
SCHEMBL24674392 0.84 MAPK1 (0.58) ESR1ESR2MAPK1HTTMAPT
SCHEMBL21392593 0.84 MAPK1 (0.58) ESR1ESR2MAPK1HTTMAPT

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-20220384734-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2022-12-01 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-20220384734-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE MCOLN2, RER1, L1CAM ESR1 27/4885ESR2 31/4885MAPK1 959/4885

“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.