SCHEMBL2515972

SCHEMBL2515972

CCO[C@H]1CN(C)C[C@H]1NC(=O)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SSTR4 P31391 1/20 0.47
▸ KCNH2 Q12809 2/20 0.45
▸ SCN5A Q14524 1/20 0.45
▸ SCN9A Q15858 1/20 0.45
▸ HDAC3 O15379 1/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC2 Q92769 1/20 0.45
▸ KDM2B Q8NHM5 1/20 0.43
▸ CCR6 P51684 1/20 0.42
▸ EPHX2 P34913 5/20 0.41
▸ NR1H4 Q96RI1 1/20 0.41
▸ TRPV1 Q8NER1 5/20 0.41
▸ MCHR1 Q99705 1/20 0.41
▸ FAAH O00519 2/20 0.41
▸ RAF1 P04049 1/20 0.41
▸ LIPE Q05469 1/20 0.41

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
SCHEMBL2520145 0.80 LIPE (0.45) HDAC3HDAC1HDAC2TRPV1LIPE
SCHEMBL5255954 0.75 GCGR (0.41) KDM2BEPHX2TRPV1LIPE
SCHEMBL2515824 0.75 GCGR (0.41) KDM2BEPHX2TRPV1LIPE
SCHEMBL2515957 0.73 EPHX2 (0.47) HDAC3HDAC1HDAC2EPHX2NR1H4
SCHEMBL2516384 0.72 USP30 (0.42) KCNH2SCN5ASCN9AHDAC3HDAC1
SCHEMBL2515969 0.71 HDAC3 (0.45) HDAC3HDAC1HDAC2EPHX2NR1H4
SCHEMBL2229141 0.71 CHRNA7 (0.64) —
SCHEMBL2229129 0.71 CHRNA7 (0.64) —
SCHEMBL5252110 0.70 USP30 (0.51) KCNH2SCN5ASCN9AHDAC3HDAC1
SCHEMBL2517945 0.70 USP30 (0.51) KCNH2SCN5ASCN9AHDAC3HDAC1

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-8034949-B2 Pyrrolidine compound and a process for preparing the same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-10-11 — — US disclosed
US-20070167440-A1 Novel pyrrolidine compound and a process for preparing the same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-07-19 — — US disclosed
EP-1748980-A1 PYRROLIDINE DERIVATIVES AS CB1-RECEPTOR ANTAGONISTS TANABE SEIYAKU CO., LTD. (JP) 2007-02-07 — — EP disclosed
WO-2005115977-A1 PYRROLIDINE DERIVATIVES AS CB1-RECEPTOR ANTAGONISTS TANABE SEIYAKU CO., LTD. (JP) 2005-12-08 — — 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-20070167440-A1 Novel pyrrolidine compound and a process for preparing the same CNR1, CNR2, OPRD1 SSTR4 291/4885KCNH2 521/4885SCN5A 1151/4885

“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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