SCHEMBL13003306

SCHEMBL13003306

CB(O)N1CCC(C(=O)N2CCC(O)CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ ALDH1A1 P00352 5/20 0.41
▸ HPGD P15428 3/20 0.41
▸ TSHR P16473 2/20 0.41
▸ CHRNB2 P17787 1/20 0.39
▸ CHRNA3 P32297 1/20 0.39
▸ CHRNA4 P43681 1/20 0.39
▸ CHRNB3 Q05901 1/20 0.39
▸ CHRNA6 Q15825 1/20 0.39
▸ RECQL P46063 1/20 0.38
▸ LMNA P02545 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ HSD11B1 P28845 1/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ LSS P48449 1/20 0.34

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
SCHEMBL14456848 0.81 CHRNB2 (0.65) SMN1; SMN2ALDH1A1HPGDTSHRCHRNB2
SCHEMBL6726839 0.81 GPR119 (0.37) TSHR
SCHEMBL13003328 0.81 TSHR (0.40) SMN1; SMN2ALDH1A1HPGDTSHRRECQL
SCHEMBL8314644 0.79 HPGD (0.62) SMN1; SMN2ALDH1A1HPGDTSHRCHRNB2
SCHEMBL14456849 0.76 CHRNB2 (0.57) SMN1; SMN2ALDH1A1HPGDTSHRCHRNB2
SCHEMBL13097342 0.75 ALDH1A1 (0.71) SMN1; SMN2ALDH1A1HPGDTSHRCHRNB2
SCHEMBL12879228 0.74 LMNA (0.43) ALDH1A1HPGDTSHRLMNAMAPT
SCHEMBL7985966 0.74 ALDH1A1 (0.75) SMN1; SMN2ALDH1A1HPGDTSHRLMNA
SCHEMBL12861004 0.74 CHRM2 (0.33) SMN1; SMN2
SCHEMBL13003329 0.73 KMT2A (0.44) SMN1; SMN2ALDH1A1HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846946-B2 Heteroatom-linked substituted piperidines and derivatives thereof useful as histamine H3 antagonists SCHERING PLOUGH CORPORATION (US) 2010-12-07 — — US disclosed
US-7635705-B2 treating allergy-induced airway responses, congestion, obesity, metabolic syndrome, alcoholic fatty liver disease, hepatic steatosis, nonalcoholic steatohepatitis, cirrhosis, hepatacellular carcinoma and cognition deficit disorders; histamine H3 antagonists SCHERING CORPORATION (US) 2009-12-22 — — US disclosed
US-20090286830-A1 HETEROATOM-LINKED SUBSTITUTED PIPERIDINES AND DERIVATIVES THEREOF USEFUL AS HISTAMINE H3 ANTAGONISTS SCHERING CORPORATION 2009-11-19 — — US disclosed
US-20070015807-A1 Heteroatom-linked substituted piperidines and derivatives thereof useful as histamine H3 antagonists SCHERING CORPORATION 2007-01-18 — — 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-20070015807-A1 Heteroatom-linked substituted piperidines and derivatives thereof useful as histamine H3 antagonists HRH3, HRH4, CHRM2 SMN1; SMN2 4688/4885ALDH1A1 1382/4885HPGD 1039/4885
US-20090286830-A1 HETEROATOM-LINKED SUBSTITUTED PIPERIDINES AND DERIVATIVES THEREOF USEFUL AS HISTAMINE H3 ANTAGONISTS HRH3, HRH4, CHRM2 SMN1; SMN2 4688/4885ALDH1A1 1382/4885HPGD 1039/4885

“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.

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