SCHEMBL24003191

SCHEMBL24003191

Fc1c(F)c(F)c2c(-c3cc4ccccc4s3)nnnc2c1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.38
PIK3CA P42336 2/20 0.38
PIK3CD O00329 1/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
PRKDC P78527 1/20 0.38
NQO1 P15559 1/20 0.37
NQO2 P16083 1/20 0.37
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
ERN1 O75460 2/20 0.35
IKBKB O14920 1/20 0.35
PLAU P00749 1/20 0.35
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
CYP19A1 P11511 1/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
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
SCHEMBL24003193 0.82 PIK3CD (0.34) APPPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL22857643 0.81 PIK3CD (0.45) APPPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL24003171 0.80 NQO1 (0.36) APPPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL28877294 0.78 ADORA2A (0.39) APPPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL28877270 0.75 PIK3CA (0.38) APPPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL29177953 0.70 APP (0.44) APPPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL29177745 0.68 APP (0.41) APPPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL845603 0.67 APP (0.63) APPNQO1NQO2ERN1HSD17B1
SCHEMBL29732980 0.67 APP (0.63) APPNQO1NQO2ERN1HSD17B1
SCHEMBL2150464 0.66 APP (0.57) APPNQO1NQO2ERN1HSD17B1

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-20210347797-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2021-11-11 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-20210347797-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, TPO APP 1808/4885PIK3CA 4443/4885PIK3CD 3586/4885

“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.