SCHEMBL6721777

SCHEMBL6721777

COc1ccccc1COCCCOc1ccc(I)cc1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.51
HPGD P15428 1/20 0.51
ATM Q13315 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
REN P00797 16/20 0.51
APP P05067 1/20 0.48
IDO1 P14902 2/20 0.45

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
SCHEMBL5710347 0.86 MAPT (0.51) MAPTHPGDATML3MBTL1REN
SCHEMBL5710536 0.86 MAPT (0.51) MAPTHPGDATML3MBTL1REN
SCHEMBL6719674 0.83 L3MBTL1 (0.46) MAPTHPGDL3MBTL1RENAPP
SCHEMBL3651157 0.82 MAPT (0.51) MAPTHPGDATML3MBTL1REN
SCHEMBL6720004 0.81 L3MBTL1 (0.42) MAPTHPGDL3MBTL1RENAPP
SCHEMBL695301 0.81 L3MBTL1 (0.54) MAPTHPGDATML3MBTL1REN
SCHEMBL6717134 0.80 L3MBTL1 (0.47) MAPTHPGDL3MBTL1RENAPP
SCHEMBL6717436 0.80 MAPT (0.52) MAPTHPGDATML3MBTL1REN
SCHEMBL6717628 0.79 SMN1; SMN2 (0.43) MAPTHPGDL3MBTL1RENIDO1
SCHEMBL1941923 0.79 IDO1 (0.53) L3MBTL1RENIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040214832-A1 Piperazine derivative renin inhibitors WARNER-LAMBERT COMPANY LLC 2004-10-28 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 (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-20040214832-A1 Piperazine derivative renin inhibitors REN, ACE, AGTR2 MAPT 3937/4885HPGD 256/4885ATM 4839/4885

“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.