SCHEMBL2978210

SCHEMBL2978210

CC(C)N1CCC(c2nc(-c3ccc(N4CCCC4)cc3)cs2)CC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.42
ENPP2 Q13822 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
ALDH1A1 P00352 3/20 0.41
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.39
ALK Q9UM73 2/20 0.39
GSK3B P49841 1/20 0.39
DYRK1A Q13627 1/20 0.39
AR P10275 1/20 0.39
TP53 P04637 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL2983037 0.85 SMN1; SMN2 (0.44) MAOAENPP2SMN1; SMN2ALDH1A1RAB9A
SCHEMBL2981922 0.84 ALDH1A1 (0.54) MAOAENPP2SMN1; SMN2ALDH1A1RAB9A
SCHEMBL2970766 0.84 L3MBTL1 (0.52) SMN1; SMN2ALDH1A1RAB9ANPC1AR
SCHEMBL2986385 0.82 RAB9A (0.58) MAOASMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL4265897 0.81 HPGDS (0.53) MAOASMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL2970736 0.81 LTA4H (0.41) ENPP2SMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL2977247 0.81 GAA (0.49) MAOAHRH3SMN1; SMN2ALDH1A1RAB9A
Bromide SCHEMBL2975839 0.81 HPGDS (0.52) MAOASMN1; SMN2RAB9ANPC1AR
SCHEMBL2969067 0.79 NPC1 (0.45) ENPP2HRH3SMN1; SMN2ALDH1A1RAB9A
SCHEMBL2970555 0.79 ALDH1A1 (0.43) ENPP2HRH3SMN1; SMN2ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7786143-B2 Thiazolyl piperidine derivatives HOFFMAN-LA ROCHE INC. (US) 2010-08-31 US claimed
EP-1945635-B1 THIAZOLYL PIPERIDINE DERIVATIVES USEFUL AS H3 RECEPTOR MODULATORS HOFFMANN LA ROCHE (CH) 2009-05-06 EP claimed
EP-1945635-A2 THIAZOLYL PIPERIDINE DERIVATIVES USEFUL AS H3 RECEPTOR MODULATORS F.HOFFMANN-LA ROCHE AG (CH) 2008-07-23 EP claimed
US-20070043083-A1 Thiazolyl piperidine derivatives HOFFMANN-LA ROCHE INC. 2007-02-22 US claimed
WO-2007020213-A2 THIAZOLYL PIPERIDINE DERIVATIVES USEFUL AS H3 RECEPTOR MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2007-02-22 WO claimed
US-7786143-B2 Thiazolyl piperidine derivatives HOFFMAN-LA ROCHE INC. (US) 2010-08-31 US disclosed
EP-1945635-B1 THIAZOLYL PIPERIDINE DERIVATIVES USEFUL AS H3 RECEPTOR MODULATORS HOFFMANN LA ROCHE (CH) 2009-05-06 EP disclosed
EP-1945635-A2 THIAZOLYL PIPERIDINE DERIVATIVES USEFUL AS H3 RECEPTOR MODULATORS F.HOFFMANN-LA ROCHE AG (CH) 2008-07-23 EP disclosed
WO-2007020213-A2 THIAZOLYL PIPERIDINE DERIVATIVES USEFUL AS H3 RECEPTOR MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2007-02-22 WO disclosed
US-20070043083-A1 Thiazolyl piperidine derivatives HOFFMANN-LA ROCHE INC. 2007-02-22 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-20070043083-A1 Thiazolyl piperidine derivatives HRH3, HRH4, H1-3 MAOA 1810/4885ENPP2 3646/4885HRH3 1/4885

“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.