SCHEMBL2715804

SCHEMBL2715804

CC(c1ccccc1)n1nc(C(=O)NCC2CCCCC2)c2c1CCCC2

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 11/20 0.49
KCNK3 O14649 3/20 0.47
RIPK1 Q13546 1/20 0.46
OPRK1 P41145 1/20 0.45
CNR2 P34972 2/20 0.43
CNR1 P21554 1/20 0.43
HTR2A P28223 3/20 0.43
KMT2A Q03164 1/20 0.42
KCNH2 Q12809 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
SCHEMBL2718857 0.83 RIPK1 (0.45) KCNK3RIPK1CNR2CNR1
SCHEMBL182444 0.79 BRD4 (0.42) KCNK3
SCHEMBL13889288 0.78 USP30 (0.48) HTR4RIPK1CNR2CNR1KMT2A
SCHEMBL182170 0.77 BRD4 (0.41) KCNK3
SCHEMBL13871533 0.76 CNR2 (0.55) CNR2CNR1
SCHEMBL14003157 0.76 CNR2 (0.47) CNR2CNR1KMT2A
SCHEMBL2712623 0.75 CYP3A4 (0.46) KMT2A
SCHEMBL2717254 0.74 CNR2 (0.65) RIPK1CNR2CNR1KMT2A
SCHEMBL13871536 0.74 CNR2 (0.46) CNR2CNR1
SCHEMBL5811700 0.71 CNR2 (0.61) RIPK1CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1735286-B1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2012-01-04 EP disclosed
US-20090099143-A1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS LAGU BHARAT 2009-04-16 US disclosed
US-20090099143-A1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS LAGU BHARAT 2009-04-16 US disclosed
US-7452997-B2 Tetrahydro-indazole cannabinoid modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2008-11-18 US disclosed
US-7452997-B2 Tetrahydro-indazole cannabinoid modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2008-11-18 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-20090099143-A1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS CNR2, CNR1, GPR18 HTR4 54/4885KCNK3 987/4885RIPK1 600/4885

“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.