SCHEMBL4925378

SCHEMBL4925378

Clc1ccc(-c2c3c(nn2-c2ccc(Cl)cc2Cl)CCCC3)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 12/20 0.51
CNR2 P34972 10/20 0.51
KCNH2 Q12809 2/20 0.51
ABCC4 O15439 1/20 0.51
MLNR O43193 1/20 0.51
ABCB11 O95342 1/20 0.51
CHRM2 P08172 1/20 0.51
ADORA3 P0DMS8 1/20 0.51
CYP2C9 P11712 1/20 0.51
ADRA2B P18089 1/20 0.51
ADRA2C P18825 1/20 0.51
DRD1 P21728 1/20 0.51
TBXA2R P21731 1/20 0.51
SLC6A2 P23975 1/20 0.51
HRH2 P25021 1/20 0.51
HTR2A P28223 1/20 0.51
AGTR1 P30556 1/20 0.51
CCKAR P32238 1/20 0.51
CCKBR P32239 1/20 0.51
MC4R P32245 1/20 0.51

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
SCHEMBL4923477 0.92 CNR1 (0.48) CNR1CNR2KCNH2ABCC4MLNR
SCHEMBL4914683 0.92 CNR1 (0.54) CNR1CNR2
SCHEMBL4926872 0.89 CNR1 (0.56) CNR1CNR2KCNH2ABCC4MLNR
SCHEMBL8132350 0.78 PTGS2 (0.59) HTR2AHTR2B
SCHEMBL5338137 0.77 CNR1 (0.51) CNR1CNR2KCNH2OPRL1
SCHEMBL695378 0.76 SRC (0.46) CNR1HTR2AHTR2B
SCHEMBL28691202 0.75 PTGS2 (0.59) CNR1HTR2AHTR2B
SCHEMBL3081746 0.74 CNR1 (0.52) CNR1CNR2KCNH2ABCC4MLNR
SCHEMBL3068288 0.74 CNR1 (0.52) CNR1CNR2KCNH2ABCC4MLNR
SCHEMBL3083146 0.74 CNR1 (0.52) CNR1CNR2KCNH2ABCC4MLNR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080058313-A1 TETRAHYDRO-2H-INDAZOLE PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2008-03-06 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-20080058313-A1 TETRAHYDRO-2H-INDAZOLE PYRAZOLE CANNABINOID MODULATORS CNR1, CNR2, GPR35 CNR1 1/4885CNR2 2/4885KCNH2 1153/4885

“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.