SCHEMBL6711052

SCHEMBL6711052

COC(=O)COCCN1CCNCC1Cc1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CHIT1 Q13231 4/20 0.37
CHIA Q9BZP6 2/20 0.36
MITF O75030 1/20 0.36
SCN5A Q14524 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN10A Q9Y5Y9 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL7950557 0.89 TDP1 (0.41) TDP1L3MBTL1CHIT1CHIAMITF
SCHEMBL3738377 0.84 TDP1 (0.41) TDP1L3MBTL1CHIT1CHIAMITF
SCHEMBL2116076 0.81 TDP1 (0.44) TDP1L3MBTL1CHIT1CHIAMITF
SCHEMBL9812322 0.80 TDP1 (0.41) TDP1L3MBTL1CHIT1CHIAMITF
SCHEMBL5695790 0.79 TDP1 (0.45) TDP1L3MBTL1CHIT1CHIAMITF
SCHEMBL5695792 0.79 TDP1 (0.47) TDP1L3MBTL1CHIT1CHIAMITF
SCHEMBL8566033 0.79 HRH3 (0.40) CHIT1HRH3
SCHEMBL6711048 0.78 CHIT1 (0.36) CHIT1CHIASCN5ASCN2ASCN10A
SCHEMBL7115205 0.75 HRH1 (0.42) TDP1MITF
Hydrochloric Acid SCHEMBL5957371 0.74 HRH1 (0.43) TDP1MITF

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-20040122023-A1 Enantiomers of 1-[(4-chlorophenyl)phenylmethyl]-4-[(4-methylphenyl) sulfonyl] piperazine COSSEMENT ERIC (BE) 2004-06-24 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-20040122023-A1 Enantiomers of 1-[(4-chlorophenyl)phenylmethyl]-4-[(4-methylphenyl) sulfonyl] piperazine RPLP1, QDPR, PRLHR TDP1 1953/4885L3MBTL1 3851/4885CHIT1 1346/4885

“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.