SCHEMBL7230715

SCHEMBL7230715

CN(C)CCCn1cc(C(=O)CN2CCCCC2)cc1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.45
USP14 P54578 3/20 0.41
USP7 Q93009 1/20 0.41
ALPL P05186 1/20 0.40
ALPG P10696 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 1/20 0.39
EPHX2 P34913 1/20 0.38
MAOB P27338 2/20 0.38
MCHR1 Q99705 1/20 0.37
POLB P06746 1/20 0.37

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
Dimethylamine SCHEMBL7230728 0.84 HRH3 (0.44) HRH3USP14USP7ALPLALPG
SCHEMBL7230721 0.77 USP14 (0.41) HRH3USP14USP7ALPLALPG
SCHEMBL6952914 0.75 MAOB (0.50) HRH3USP14USP7ALPLALPG
Hydrochloric Acid SCHEMBL6957210 0.74 MAOB (0.48) HRH3USP14USP7ALPLALPG
SCHEMBL7233635 0.73 ADORA1 (0.46) SMN1; SMN2ALDH1A1POLB
SCHEMBL26921088 0.72 ALDH1A1 (0.62) HRH3USP14USP7ALPLALPG
SCHEMBL26921192 0.71 ALDH1A1 (0.59) HRH3USP14USP7ALPLALPG
SCHEMBL7226430 0.67 HTT (0.49) HRH3USP14USP7ALPLALPG
SCHEMBL9013246 0.67 SIGMAR1 (0.46) MCHR1
SCHEMBL13739264 0.67 USP14 (0.50) USP14USP7SMN1; SMN2

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-6573267-B2 Central nervous system disorders ORTHO-MCNEIL PHARMACEUTICAL, INC. 2003-06-03 US disclosed
US-20020019436-A1 Useful aroyl aminoacyl pyrrole compounds ORTHO-MCNEIL PHARMACEUTICAL, INC. 2002-02-14 US disclosed
WO-2002002521-A2 AROYL AMINOACYL PYRROLE COMPOUNDS AND THEIR PHARMACEUTICAL USE ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2002-01-10 WO 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-20020019436-A1 Useful aroyl aminoacyl pyrrole compounds ABAT, GAP43, AADAT HRH3 1152/4885USP14 3445/4885USP7 4116/4885

“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.