SCHEMBL4493029

SCHEMBL4493029

CCc1nc(Nc2cccc(Cl)c2)ncc1C(=O)N(C)C1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.54
CYP2C9 P11712 7/20 0.54
CYP2C19 P33261 7/20 0.54
CYP3A4 P08684 6/20 0.54
CYP1A2 P05177 5/20 0.52
CYP2D6 P10635 4/20 0.52
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
GRM5 P41594 1/20 0.44
SYK P43405 1/20 0.44
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
LCK P06239 1/20 0.43
JAK3 P52333 1/20 0.43
HSD11B1 P28845 1/20 0.43

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
SCHEMBL4479176 0.86 CNR2 (0.52) CNR2CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL4493023 0.81 CNR2 (0.73) CNR2CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL4475764 0.80 CNR2 (0.53) CNR2CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL4471993 0.76 MAPT (0.58) CNR2CYP2C9CYP2C19CYP1A2SYK
SCHEMBL3378679 0.75 CNR2 (0.71) CNR2CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL13672511 0.75 CNR2 (0.74) CNR2CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL3380609 0.74 CNR2 (0.71) CNR2CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL3378827 0.74 CNR2 (0.71) CNR2CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL6471548 0.73 CNR2 (0.74) CNR2CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL3379907 0.73 CNR2 (0.54) CNR2CYP2C9CYP2C19CYP3A4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264452-A1 2-(Phenylamino)-Pyrimidin-5-Amides As Cannabinoid 2 Receptors Modulators for the Treatment of Immune or Inflammatory Disorders GLAXO GROUP LIMITED (GB) 2009-10-22 US disclosed
EP-1711475-A1 2-(PHENYLAMINO)-PYRIMIDIN-5-AMIDES AS CANNABINOID 2 RECEPTORS MODULATORS FOR THE TREATMENT OF IMMUNE OR INFLAMMATORY DISORDERS. GLAXO GROUP LIMITED (GB) 2006-10-18 EP disclosed
WO-2005075440-A1 2- (PHENYLAMINO) -PYRIMIDIN-5-AMIDES AS CANNABINOID 2 RECEPTORS MODULATORS FOR THE TREATMENT OF IMMUNE OR INFLAMMATORY DISORDERS GLAXO GROUP LIMITED (GB) 2005-08-18 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 (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-20090264452-A1 2-(Phenylamino)-Pyrimidin-5-Amides As Cannabinoid 2 Receptors Modulators for the Treatment of Immune or Inflammatory Disorders CNR2, CNR1, P2RY2 CNR2 1/4885CYP2C9 1051/4885CYP2C19 544/4885

“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.