SCHEMBL6404030

SCHEMBL6404030

CCc1ccc2cccc(C(=O)c3c[nH]c4ccccc34)c2c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.56
GPR84 Q9NQS5 1/20 0.56
KDR P35968 4/20 0.49
MC4R P32245 2/20 0.48
MC5R P33032 2/20 0.48
CFTR P13569 1/20 0.47
GABRA1 P14867 1/20 0.47
GABRB2 P47870 1/20 0.47
NR4A2 P43354 1/20 0.47
CREBBP Q92793 1/20 0.47
PBRM1 Q86U86 1/20 0.47
PIM1 P11309 1/20 0.46
CDC25B P30305 1/20 0.46
MC3R P41968 1/20 0.46

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
SCHEMBL6429589 0.85 GPR84 (0.52) CNR2GPR84KDRMC4RMC5R
SCHEMBL6327424 0.84 GPR84 (0.60) CNR2GPR84KDRNR4A2CREBBP
SCHEMBL8530849 0.83 GPR84 (0.77) CNR2GPR84NR4A2CREBBPPBRM1
SCHEMBL29489280 0.83 GPR84 (0.77) CNR2GPR84NR4A2CREBBPPBRM1
SCHEMBL6402031 0.81 SMN1; SMN2 (0.63) CNR2GPR84KDRGABRA1GABRB2
SCHEMBL6401553 0.75 GPR84 (0.68) CNR2GPR84CFTRNR4A2CREBBP
SCHEMBL2028344 0.75 GPR84 (1.00) GPR84NR4A2CREBBPPBRM1PIM1
SCHEMBL6325416 0.74 CNR2 (0.53) CNR2CDC25B
SCHEMBL6323376 0.74 NR4A1 (0.55) CNR2NR4A2CDC25B
SCHEMBL5990471 0.74 CDC25B (0.56) CNR2CDC25B

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-20050009903-A1 CB2-selective cannabinoid analogues CLEMSON UNIVERSITY 2005-01-13 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-20050009903-A1 CB2-selective cannabinoid analogues CNR2, CNR1, GPR68 CNR2 1/4885GPR84 47/4885KDR 762/4885

“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.