SCHEMBL20133145

SCHEMBL20133145

Cn1c2ccncc2c2ccc(-c3ccc(O[C@H]4C[C@H](OCCCC(F)(F)COC5CCNCC5)C4)nc3)cc21

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 2/20 0.36
CTSS P25774 2/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
ATM Q13315 1/20 0.33
ATR Q13535 1/20 0.33
METAP2 P50579 1/20 0.31
MCHR1 Q99705 2/20 0.31
PAICS P22234 1/20 0.31
RIOK2 Q9BVS4 1/20 0.30
NTRK1 P04629 1/20 0.30

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
SCHEMBL20129222 0.89
SCHEMBL20129279 0.89 TDO2 (0.37) TDO2CTSSPIK3CAMTORATM
SCHEMBL27098081 0.88 TDO2 (0.32) TDO2
SCHEMBL27098044 0.88 TDO2 (0.32) TDO2
SCHEMBL20133144 0.87 SGMS2 (0.38)
SCHEMBL20233838 0.85 LIPG (0.35) TDO2
SCHEMBL20133143 0.84 DGAT2 (0.31)
SCHEMBL20120485 0.83 TDO2 (0.33) TDO2PIK3CAMTORATMATR
SCHEMBL29548120 0.83 TDO2 (0.33) TDO2PIK3CAMTORATMATR
SCHEMBL20120487 0.83 TDO2 (0.33) TDO2PIK3CAMTORATMATR

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 TDO2 3503/4885CTSS 3204/4885PIK3CA 2277/4885
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE CRBN, VHL, UBQLN2 TDO2 3395/4885CTSS 2761/4885PIK3CA 2528/4885

“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.