SCHEMBL2428778

SCHEMBL2428778

COCCNC(=O)c1ccc(C(=O)O)cn1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 3/20 0.63
P4HTM Q9NXG6 2/20 0.53
P4HA1 P13674 1/20 0.53
MIF P14174 1/20 0.53
MAPK1 P28482 3/20 0.53
KDM4E B2RXH2 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HPGD P15428 3/20 0.52
ALDH1A1 P00352 2/20 0.51
RECQL P46063 1/20 0.47
MAPT P10636 1/20 0.47
TP53 P04637 1/20 0.46
MAOB P27338 1/20 0.46

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
SCHEMBL13116578 0.91 HPGD (0.57) HCAR3MAPK1KDM4EHPGDALDH1A1
SCHEMBL22269020 0.85 HCAR3 (0.59) HCAR3P4HTMP4HA1MIFMAPK1
SCHEMBL841296 0.82 TSHR (0.59) HCAR3P4HTMP4HA1MIFMAPK1
SCHEMBL9561573 0.82 ALDH1A1 (0.69) KDM4EL3MBTL1HPGDALDH1A1TP53
SCHEMBL841762 0.81 GRM5 (0.54) HCAR3P4HTMP4HA1MIF
SCHEMBL7105040 0.81 HPGD (0.54) MAPK1KDM4EL3MBTL1HPGDALDH1A1
SCHEMBL3213436 0.81 RECQL (0.61) KDM4EL3MBTL1HPGDALDH1A1RECQL
SCHEMBL8868915 0.80 P4HTM (0.66) P4HTMHPGDALDH1A1
SCHEMBL1783228 0.79 P4HTM (0.53) HCAR3P4HTMP4HA1MIFKDM4E
SCHEMBL23470985 0.79 HPGD (0.73) HCAR3MAPK1HPGDALDH1A1TP53

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-8618159-B2 Substituted N-phenyl-bipyrrolidine carboxamides and therapeutic use thereof SANOFI (FR) 2013-12-31 US disclosed
EP-2205558-B1 SUBSTITUTED N-PHENYL-PYRROLIDINYLMETHYLPYRROLIDINE AMIDES AND THERAPEUTIC USE THEREOF AS HISTAMINE H3 RECEPTOR MODULATORS SANOFI SA (FR) 2012-07-25 EP disclosed
US-8227504-B2 Substituted N-phenyl-pyrrolidinylmethylpyrrolidine amides and therapeutic use thereof SANOFI (FR) 2012-07-24 US disclosed
EP-2212282-B1 SUBSTITUTED N-PHENYL-BIPYRROLIDINE CARBOXAMIDES AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2011-09-21 EP disclosed
EP-2212282-A1 SUBSTITUTED N-PHENYL-BIPYRROLIDINE CARBOXAMIDES AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2010-08-04 EP disclosed
EP-2205558-A1 SUBSTITUTED N-PHENYL-PYRROLIDINYLMETHYLPYRROLIDINE AMIDES AND THERAPEUTIC USE THEREOF AS HISTAMINE H3 RECEPTOR MODULATORS Sanofi-Aventis (FR) 2010-07-14 EP disclosed
US-20100173898-A1 SUBSTITUTED N-PHENYL-PYRROLIDINYLMETHYLPYRROLIDINE AMIDES AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-07-08 US disclosed
US-20100173897-A1 SUBSTITUTED N-PHENYL-BIPYRROLIDINE CARBOXAMIDES AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-07-08 US disclosed
WO-2009052065-A1 SUBSTITUTED N-PHENYL-BIPYRROLIDINE CARBOXAMIDES AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-04-23 WO disclosed
WO-2009052063-A1 SUBSTITUTED N-PHENYL-PYRROLIDINYLMETHYLPYRROLIDINE AMIDES AND THERAPEUTIC USE THEREOF AS HISTAMINE H3 RECEPTOR MODULATORS SANOFI-AVENTIS (FR) 2009-04-23 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 (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-20100173897-A1 SUBSTITUTED N-PHENYL-BIPYRROLIDINE CARBOXAMIDES AND THERAPEUTIC USE THEREOF HRH3, HRH4, CNR1 HCAR3 8/4885P4HTM 417/4885P4HA1 307/4885
US-20100173898-A1 SUBSTITUTED N-PHENYL-PYRROLIDINYLMETHYLPYRROLIDINE AMIDES AND THERAPEUTIC USE THEREOF HRH3, HRH4, CNR1 HCAR3 11/4885P4HTM 229/4885P4HA1 184/4885

“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.