SCHEMBL20129048

SCHEMBL20129048

Cc1ccc(S(=O)(=O)OCCCCCCOc2cccc(O[C@H]3C[C@H](Oc4ccc(-c5ccc6c7cnccc7n(C)c6c5)cn4)C3)n2)cc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.33
ATM Q13315 13/20 0.33
MTOR P42345 13/20 0.33
PIK3CA P42336 12/20 0.33
ATR Q13535 5/20 0.33
CYP24A1 Q07973 2/20 0.33
KCNH2 Q12809 1/20 0.31

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
SCHEMBL20129052 0.90 PIK3CA (0.31) FAAHATMMTORPIK3CAATR
SCHEMBL20129058 0.89 ATM (0.31) ATMMTORPIK3CAATR
SCHEMBL20129051 0.86 FAAH (0.37) FAAHATMMTORPIK3CAATR
SCHEMBL27098359 0.85 ATM (0.36) ATMMTORPIK3CAATRKCNH2
SCHEMBL27097844 0.84
SCHEMBL20129180 0.83
SCHEMBL20129050 0.83 FAAH (0.39) FAAHATMMTORPIK3CAATR
SCHEMBL27098121 0.83 FAAH (0.31) FAAH
SCHEMBL20129091 0.81 CA12 (0.33) ATMMTORPIK3CAATR
SCHEMBL20423462 0.81 CA12 (0.33) ATMMTORPIK3CAATR

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 FAAH 4345/4885ATM 711/4885MTOR 765/4885
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE CRBN, VHL, UBQLN2 FAAH 4290/4885ATM 959/4885MTOR 945/4885

“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.