SCHEMBL11957719

SCHEMBL11957719

O=S(=O)(c1ccccc1)N1CCN(c2ccc(Cl)cc2Cl)C(c2ccc(Cl)cc2)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.45
PKM P14618 3/20 0.45
KDM4E B2RXH2 2/20 0.45
HTT P42858 2/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 2/20 0.43
MDM2 Q00987 1/20 0.43
PSEN1 P49768 1/20 0.43
PSEN2 P49810 1/20 0.43
APH1B Q8WW43 1/20 0.43
NCSTN Q92542 1/20 0.43
APH1A Q96BI3 1/20 0.43
PSENEN Q9NZ42 1/20 0.43
GPR183 P32249 1/20 0.43
MEN1 O00255 1/20 0.43
CNR1 P21554 1/20 0.42
PTGDR2 Q9Y5Y4 2/20 0.42
ATM Q13315 1/20 0.42
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
SCHEMBL11958256 0.94 ATM (0.48) ALDH1A1PKMHTTKMT2AMDM2
SCHEMBL11958288 0.94 MEN1 (0.47) ALDH1A1SMN1; SMN2HTTGAAKMT2A
SCHEMBL11958259 0.92 ALDH1A1 (0.52) ALDH1A1PKMKDM4EHTTKMT2A
SCHEMBL11958296 0.91 MAPT (0.48) ALDH1A1SMN1; SMN2PKMHTTKMT2A
SCHEMBL11958284 0.90 CNR1 (0.43) ALDH1A1PKMHTTKMT2AMDM2
SCHEMBL11958241 0.89 PKM (0.47) ALDH1A1SMN1; SMN2PKMHTTKMT2A
SCHEMBL11958243 0.89 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2PKMHTTGAA
SCHEMBL11958239 0.89 DPP4 (0.49) ALDH1A1SMN1; SMN2PKMKDM4EHTT
SCHEMBL11958290 0.89 ATM (0.43) ALDH1A1PKMHTTKMT2AMDM2
SCHEMBL11958270 0.88 PKM (0.47) ALDH1A1SMN1; SMN2PKMKDM4EHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8236805-B2 Substituted piperazines as CB1 antagonists INTERVET INC. (US) 2012-08-07 US disclosed
US-8236805-B2 Substituted piperazines as CB1 antagonists INTERVET INC. (US) 2012-08-07 US disclosed
US-7700597-B2 Substituted piperazines as CB1 antagonists SCHERING CORPORATION (US) 2010-04-20 US disclosed
US-7700597-B2 Substituted piperazines as CB1 antagonists SCHERING CORPORATION (US) 2010-04-20 US disclosed
US-20100029607-A1 Substituted Piperazines as CB1 Antagonists SCHERING CORPORATION 2010-02-04 US disclosed
US-20100029607-A1 Substituted Piperazines as CB1 Antagonists SCHERING CORPORATION 2010-02-04 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-20100029607-A1 Substituted Piperazines as CB1 Antagonists CNR1, CNR2, GPR119 ALDH1A1 1520/4885SMN1; SMN2 3488/4885PKM 2530/4885

“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.