SCHEMBL4084965

SCHEMBL4084965

Cn1cnc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1Cl

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 4/20 0.61
HSD11B1 P28845 3/20 0.49
DPP4 P27487 1/20 0.48
DPP8 Q6V1X1 1/20 0.48
KDM5B Q9UGL1 1/20 0.47
NSD2 O96028 1/20 0.47
F2RL3 Q96RI0 1/20 0.47
KDM2B Q8NHM5 1/20 0.43
CRHR1 P34998 2/20 0.41
CNR1 P21554 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
SCHEMBL4085411 0.89 KDM4C (0.57) KDM4CHSD11B1DPP4DPP8KDM5B
SCHEMBL4083519 0.89 NSD2 (0.56) KDM4CHSD11B1DPP4DPP8KDM5B
SCHEMBL16034143 0.78 KDM4C (0.64) KDM4CDPP4DPP8KDM5BNSD2
SCHEMBL16034475 0.77 KDM4C (1.00) KDM4CKDM5BKDM2B
SCHEMBL4562976 0.76 KDM4C (0.51) KDM4CHSD11B1KDM5BNSD2KDM2B
SCHEMBL4076257 0.73 DPP4 (0.49) HSD11B1DPP4DPP8NSD2CNR1
SCHEMBL14996667 0.70 HSD11B1 (0.53) HSD11B1DPP4CRHR1
SCHEMBL14996575 0.70 HSD11B1 (0.53) HSD11B1CRHR1
SCHEMBL4075928 0.70 DPP4 (0.49) HSD11B1DPP4DPP8
SCHEMBL6345578 0.69 F2RL3 (0.52) KDM4CHSD11B1DPP4DPP8F2RL3

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
US-7572785-B2 Substituted imidazoles as cannabinoid receptor modulators MERCK & CO., INC. (US) 2009-08-11 US disclosed
US-7057051-B2 Substituted imidazoles as cannabinoid receptor modulators MERCK & CO., INC. (US) 2006-06-06 US disclosed
US-20060089356-A1 Substituted imidazoles as cannabinoid receptor modulators MERCK SHARP & DOHME CORP. 2006-04-27 US disclosed
US-20030114495-A1 Substituted imidazoles as cannabinoid receptor modulators MERCK SHARP & DOHME CORP. 2003-06-19 US disclosed
WO-2003007887-A2 SUBSTITUTED IMIDAZOLES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO., INC. (US) 2003-01-30 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-20060089356-A1 Substituted imidazoles as cannabinoid receptor modulators CNR1, CNR2, GPR119 KDM4C 3003/4885HSD11B1 4190/4885DPP4 3477/4885
US-20030114495-A1 Substituted imidazoles as cannabinoid receptor modulators CNR1, CNR2, GPR119 KDM4C 3003/4885HSD11B1 4190/4885DPP4 3477/4885

“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.