SCHEMBL20133183

SCHEMBL20133183

Cn1c2ccncc2c2ccc(-c3ccc(OC4CCN(CCOCCCOC5CNC5)CC4)nc3)cc21

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.37
TDO2 P48775 1/20 0.37
ATM Q13315 13/20 0.35
ATR Q13535 7/20 0.35
MTOR P42345 10/20 0.35
PIK3CA P42336 7/20 0.34
HRH3 Q9Y5N1 1/20 0.34
KCNH2 Q12809 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
SCHEMBL20120485 0.91 TDO2 (0.33) GSK3BTDO2ATMATRMTOR
SCHEMBL20120487 0.91 TDO2 (0.33) GSK3BTDO2ATMATRMTOR
SCHEMBL29548120 0.91 TDO2 (0.33) GSK3BTDO2ATMATRMTOR
SCHEMBL20129249 0.90 GSK3B (0.31) GSK3BTDO2ATMATRMTOR
SCHEMBL20133169 0.88 PIK3CD (0.37) GSK3BTDO2ATMATRPIK3CA
SCHEMBL27097879 0.87 ATM (0.36) ATMATRMTORPIK3CAKCNH2
SCHEMBL20129161 0.86 FAAH (0.33) GSK3BTDO2ATMATRMTOR
SCHEMBL20129086 0.85 CTSS (0.36) ATMATR
SCHEMBL29547511 0.83 TDO2 (0.38) GSK3BTDO2ATMATRMTOR
SCHEMBL20129037 0.83 TDO2 (0.38) GSK3BTDO2ATMATRMTOR

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 2 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
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 GSK3B 94/4885TDO2 3503/4885ATM 711/4885
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE CRBN, VHL, UBQLN2 GSK3B 227/4885TDO2 3395/4885ATM 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.