SCHEMBL1260411

SCHEMBL1260411

Cn1c(C(=O)O)cc(-c2ccccc2Cl)c1-c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.43
RHEB Q15382 1/20 0.42
MCL1 Q07820 1/20 0.41
CCR2 P41597 2/20 0.40
GRIA2 P42262 1/20 0.40
GRIA4 P48058 1/20 0.40
MAP4K4 O95819 1/20 0.40
HSD11B1 P28845 2/20 0.39
KMT2A Q03164 1/20 0.39
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
CTRC Q99895 1/20 0.38
KDM5A P29375 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
KDM5B Q9UGL1 1/20 0.38
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37

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
SCHEMBL1259826 0.89 CYP2C9 (0.42) CNR1RHEBMCL1GRIA2GRIA4
SCHEMBL1260378 0.87 CNR1 (0.49) CNR1HSD11B1KMT2A
SCHEMBL2570109 0.81 ESR1 (0.51) CNR1HSD11B1KMT2A
SCHEMBL1258893 0.78 MARS1 (0.52) CNR1CCR2KMT2A
SCHEMBL12484647 0.78 RHEB (0.44) CNR1RHEBMCL1CCR2KMT2A
SCHEMBL1258848 0.77 TACR1 (0.51)
SCHEMBL5260699 0.76 PTGES (0.37) CNR1
SCHEMBL2906434 0.75 HSD11B1 (0.47) CNR1HSD11B1
SCHEMBL1260389 0.75 CNR1 (0.53) CNR1
SCHEMBL1260967 0.75 KMT2A (0.43) CNR1KMT2A

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-7879902-B2 Psychological disorders; eating disorders; metabolism disorders; cognition activators; alcoholism; drug abruse thereapy SANOFI-AVENTIS (FR) 2011-02-01 US disclosed
US-20080194581-A1 PYRROLE DERIVATIVES, INTERMEDIATES THEREFOR, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2008-08-14 US disclosed
US-7381727-B2 Pyrrole derivatives, their preparation and their therapeutic use SANOFI-AVENTIS (FR) 2008-06-03 US disclosed
US-20070149596-A1 PYRROLE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANOFI-AVENTIS (FR) 2007-06-28 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-20080194581-A1 PYRROLE DERIVATIVES, INTERMEDIATES THEREFOR, PREPARATION AND THERAPEUTIC USE THEREOF PYCR1, FARS2, WEE1 CNR1 543/4885RHEB 292/4885MCL1 2326/4885
US-20070149596-A1 PYRROLE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE PYCR1, PRMT9, PRLHR CNR1 125/4885RHEB 52/4885MCL1 1072/4885

“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.