SCHEMBL6102004

SCHEMBL6102004

O=c1n(Cc2ccc(C(F)(F)F)nc2)nc2ncc(-c3ccncc3)c(-c3ccc(Cl)cc3)n12

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 14/20 0.63
CYP2C9 P11712 6/20 0.57
CYP2C19 P33261 6/20 0.57
CYP3A4 P08684 5/20 0.57
NR3C1 P04150 2/20 0.40
NR1H2 P55055 2/20 0.38
NR1H3 Q13133 2/20 0.38
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PREP P48147 1/20 0.36

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
SCHEMBL4493006 0.81 CNR1 (0.64) CNR1CYP2C9CYP2C19CYP3A4NR3C1
SCHEMBL4469608 0.81 CNR1 (0.72) CNR1CYP2C9CYP2C19CYP3A4NR3C1
SCHEMBL6100004 0.80 CNR1 (0.64) CNR1CYP2C9CYP2C19CYP3A4NR3C1
SCHEMBL6102255 0.80 CNR1 (0.64) CNR1CYP2C9CYP2C19CYP3A4NR3C1
SCHEMBL4492938 0.79 CNR1 (0.75) CNR1CYP2C9CYP2C19CYP3A4NR3C1
SCHEMBL4798385 0.78 CNR1 (1.00) CNR1CYP2C9CYP2C19CYP3A4NR3C1
SCHEMBL4838798 0.77 CNR1 (0.69) CNR1CYP2C9CYP2C19CYP3A4NR3C1
SCHEMBL13135006 0.77 CNR1 (1.00) CNR1CYP2C9CYP2C19CYP3A4
SCHEMBL14211072 0.76 CNR1 (1.00) CNR1CYP2C9CYP2C19CYP3A4NR3C1
SCHEMBL4491833 0.74 CNR1 (0.52) CNR1CYP2C9CYP2C19CYP3A4NR3C1

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-20060287342-A1 Triazolopyrimidine heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY 2006-12-21 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-20060287342-A1 Triazolopyrimidine heterocycles as cannabinoid receptor modulators CNR1, CNR2, GPR18 CNR1 1/4885CYP2C9 231/4885CYP2C19 110/4885

“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.