SCHEMBL24674410

SCHEMBL24674410

CC(C)(C)c1nc2ccccc2n1-c1ccc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3cc(-c4ccccc4)ccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.36
ESR2 Q92731 3/20 0.36
PIK3CD O00329 2/20 0.36
PIK3CA P42336 2/20 0.36
MTOR P42345 2/20 0.36
CNR2 P34972 1/20 0.36
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPK10 P53779 1/20 0.33
SLC22A12 Q96S37 1/20 0.33
PIK3C2A O00443 1/20 0.33
PIK3C2B O00750 1/20 0.33
CHEK1 O14757 1/20 0.33
ABCB11 O95342 1/20 0.33
CSF1R P07333 1/20 0.33
MET P08581 1/20 0.33
PIK3R1 P27986 1/20 0.33

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
SCHEMBL24674274 0.94 ESR1 (0.40) ESR1ESR2CNR2MAPK1HTT
SCHEMBL24674133 0.94 ESR1 (0.40) ESR1ESR2CNR2MAPK1HTT
SCHEMBL24673724 0.94 ESR1 (0.40) ESR1ESR2CNR2MAPK1HTT
SCHEMBL14499562 0.93 CNR2 (0.40) ESR1ESR2PIK3CDPIK3CAMTOR
SCHEMBL23022724 0.86 MAPK1 (0.51) ESR1ESR2PIK3CDPIK3CAMTOR
SCHEMBL17932821 0.85 ESR1 (0.52) ESR1ESR2PIK3CDPIK3CAMTOR
SCHEMBL20906742 0.85 ESR1 (0.52) ESR1ESR2PIK3CDPIK3CAMTOR
SCHEMBL25668147 0.85 ESR1 (0.52) ESR1ESR2PIK3CDPIK3CAMTOR
SCHEMBL14499586 0.85 ALDH1A1 (0.39) ESR1ESR2PIK3CDPIK3CAMTOR
SCHEMBL24674409 0.84 PDE10A (0.44) ESR1ESR2PIK3CDPIK3CAMTOR

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 31/4885PIK3CD 4740/4885

“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.