SCHEMBL23926977

SCHEMBL23926977

COc1cc(Oc2ccc(Nc3ncncc3Br)cn2)ccc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 4/20 0.41
PIK3CD O00329 3/20 0.41
PIK3CA P42336 3/20 0.41
PIK3CB P42338 3/20 0.41
PIP4K2A P48426 2/20 0.40
CYP1A2 P05177 5/20 0.39
CYP3A4 P08684 5/20 0.39
CYP2D6 P10635 5/20 0.39
CYP2C19 P33261 5/20 0.39
MAPK1 P28482 3/20 0.39
LMNA P02545 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALOX15 P16050 3/20 0.39
HSD17B10 Q99714 3/20 0.39
EGFR P00533 6/20 0.37
KDR P35968 3/20 0.37
CLK4 Q9HAZ1 1/20 0.37
TSHR P16473 2/20 0.37
ULK1 O75385 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL30079817 1.00 PIK3CG (0.41) PIK3CGPIK3CDPIK3CAPIK3CBPIP4K2A
SCHEMBL23927082 0.87 PIK3CA (0.46) PIK3CGPIK3CDPIK3CAPIK3CBPIP4K2A
SCHEMBL30079725 0.87 PIK3CA (0.46) PIK3CGPIK3CDPIK3CAPIK3CBPIP4K2A
SCHEMBL30079787 0.81 PIK3CA (0.42) PIK3CGPIK3CDPIK3CAPIK3CBPIP4K2A
SCHEMBL23927019 0.81 PIK3CA (0.42) PIK3CGPIK3CDPIK3CAPIK3CBPIP4K2A
SCHEMBL116773 0.80 PIK3CG (0.55) PIK3CGPIK3CDPIK3CAPIK3CBPIP4K2A
SCHEMBL23927074 0.78 PIK3CA (0.43) PIK3CGPIK3CDPIK3CAPIK3CBPIP4K2A
SCHEMBL23926990 0.78 PIK3CA (0.48) PIK3CGPIK3CDPIK3CAPIK3CBPIP4K2A
SCHEMBL30079796 0.78 PIK3CA (0.48) PIK3CGPIK3CDPIK3CAPIK3CBPIP4K2A
SCHEMBL30079642 0.78 PIK3CA (0.43) PIK3CGPIK3CDPIK3CAPIK3CBPIP4K2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230124087-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS HOFFMANN-LA ROCHE INC. (US) 2023-04-20 US disclosed
EP-4139306-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS F. Hoffmann-La Roche AG (CH) 2023-03-01 EP disclosed
CN-115380032-A KV3 enhancers for the treatment of cognitive disorders 豪夫迈·罗氏有限公司 2022-11-22 CN disclosed
WO-2021214090-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2021-10-28 WO disclosed
EP-3901152-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS F. Hoffmann-La Roche AG (CH) 2021-10-27 EP 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-20230124087-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS KCNN3, KCNA4, KCNA3 PIK3CG 2454/4885PIK3CD 2501/4885PIK3CA 2780/4885

“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.