SCHEMBL10108244

SCHEMBL10108244

COC(=O)N1CCC(NCCc2ccc(Br)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HTT P42858 1/20 0.49
DRD4 P21917 1/20 0.46
KDM4E B2RXH2 3/20 0.46
CHRM2 P08172 4/20 0.45
CHRM5 P08912 4/20 0.45
CHRM3 P20309 3/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TPSAB1 Q15661 1/20 0.44
TPSD1 Q9BZJ3 1/20 0.44
TPSG1 Q9NRR2 1/20 0.44
CHRM1 P11229 1/20 0.44
DRD2 P14416 1/20 0.44
FAAH O00519 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
USP2 O75604 1/20 0.42

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
SCHEMBL18129124 0.88 FPR2 (0.49) ALDH1A1HTTDRD4KDM4E
SCHEMBL10125909 0.85 DRD4 (0.52) ALDH1A1SMN1; SMN2HTTDRD4KDM4E
SCHEMBL5368555 0.77 KDM4E (0.70) ALDH1A1SMN1; SMN2DRD4KDM4ECHRM2
SCHEMBL1239334 0.77 TAAR1 (0.53) ALDH1A1KMT2ATAAR1
SCHEMBL17854056 0.77 GPR119 (0.55) ALDH1A1SMN1; SMN2HTTKDM4EMEN1
SCHEMBL5013239 0.75 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2HTTKDM4EMEN1
SCHEMBL2106890 0.75 STS (0.57) ALDH1A1DRD4KDM4ECHRM2CHRM5
SCHEMBL29101911 0.74 TAAR1 (0.44) SMN1; SMN2DRD4TAAR1
SCHEMBL2553251 0.74 TAAR1 (0.57) SMN1; SMN2KDM4ETAAR1
SCHEMBL16799143 0.74 PDE4B (0.47) ALDH1A1SMN1; SMN2HTTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8110574-B2 Derivatives of 4-aminopiperidine and their use as a medicament IPSEN PHARMA S.A.S. (FR) 2012-02-07 US disclosed
US-20110059971-A1 DERIVATIVES OF 4-AMINOPIPERIDINE AND THEIR USE AS A MEDICAMENT IPSEN S.A.S. (FR) 2011-03-10 US disclosed
US-7858789-B2 Derivatives of 4-aminopiperidine and their use as a medicament IPSEN PHARMA S.A.S. (FR) 2010-12-28 US disclosed
US-20090149652-A1 Derivatives of 4-aminopiperidine and their use as a medicament SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES 2009-06-11 US disclosed
US-7393861-B2 Derivatives of 4-aminopiperidine and their use as a medicament SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2008-07-01 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-20090149652-A1 Derivatives of 4-aminopiperidine and their use as a medicament SSTR4, SSTR3, SSTR1 ALDH1A1 1795/4885SMN1; SMN2 2151/4885HTT 3890/4885
US-20110059971-A1 DERIVATIVES OF 4-AMINOPIPERIDINE AND THEIR USE AS A MEDICAMENT SSTR4, SSTR3, SSTR1 ALDH1A1 1795/4885SMN1; SMN2 2151/4885HTT 3890/4885

“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.