SCHEMBL20133169

SCHEMBL20133169

Cn1c2ccncc2c2ccc(-c3ccc(OC4CCN(C(=O)COCCCOC5CNC5)CC4)nc3)cc21

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.37
PIK3CA P42336 3/20 0.37
PIK3CB P42338 3/20 0.37
PIK3CG P48736 2/20 0.37
TDO2 P48775 2/20 0.36
NAMPT P43490 2/20 0.35
FAAH O00519 4/20 0.35
GSK3B P49841 2/20 0.35
DYRK1A Q13627 1/20 0.35
TBK1 Q9UHD2 1/20 0.35
LIPE Q05469 1/20 0.34
LTA4H P09960 2/20 0.34
ATM Q13315 1/20 0.34
ATR Q13535 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
GRIN2B Q13224 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
SCHEMBL20129212 0.92 FAAH (0.34) PIK3CDPIK3CAPIK3CBPIK3CGTDO2
SCHEMBL20233826 0.88 GPR119 (0.39) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20133183 0.88 GSK3B (0.37) PIK3CATDO2GSK3BATMATR
SCHEMBL29548120 0.86 TDO2 (0.33) PIK3CATDO2FAAHGSK3BATM
SCHEMBL20120487 0.86 TDO2 (0.33) PIK3CATDO2FAAHGSK3BATM
SCHEMBL20120485 0.86 TDO2 (0.33) PIK3CATDO2FAAHGSK3BATM
SCHEMBL20129161 0.81 FAAH (0.33) PIK3CATDO2FAAHGSK3BATM
SCHEMBL20129278 0.81 GPR119 (0.40) PIK3CDTBK1
SCHEMBL20129249 0.81 GSK3B (0.31) PIK3CATDO2FAAHGSK3BATM
SCHEMBL20120882 0.80 TDO2 (0.34) PIK3CATDO2FAAHATMATR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912699-B2 Tau-protein targeting compounds and associated ARVINAS OPERATIONS, INC. (US) 2024-02-27 US disclosed
WO-2018102067-A2 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE Arvinas, Inc. (US) 2018-06-07 WO disclosed
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2018-05-10 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 (2 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-11912699-B2 Tau-protein targeting compounds and associated MAPT, VHL, CRBN PIK3CD 2235/4885PIK3CA 2277/4885PIK3CB 1659/4885
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE CRBN, VHL, UBQLN2 PIK3CD 2652/4885PIK3CA 2528/4885PIK3CB 2106/4885

“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.