SCHEMBL5078982

SCHEMBL5078982

CC(C)c1ccncc1C(=O)NCc1ccc(F)cc1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.57
CNR2 P34972 1/20 0.56
KMT2A Q03164 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C19 P33261 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
POLB P06746 2/20 0.52
LMNA P02545 1/20 0.51
HTT P42858 2/20 0.49
KDM4E B2RXH2 1/20 0.49
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.49
RAB9A P51151 1/20 0.49
CCR1 P32246 1/20 0.48
ROCK2 O75116 1/20 0.48
GAA P10253 1/20 0.48
MAPK1 P28482 1/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL5079089 0.79 CNR2 (0.67) CNR2KMT2ACYP1A2CYP2C19SMN1; SMN2
SCHEMBL5080772 0.78 CNR2 (0.51) CNR2KMT2ASMN1; SMN2POLBHTT
SCHEMBL12261441 0.77 MKNK1 (0.44) SMN1; SMN2LMNANPC1ALDH1A1RAB9A
SCHEMBL12261505 0.77 TGFBR1 (0.60) CNR2KMT2A
SCHEMBL19523059 0.76 TGFBR1 (0.53) CNR2SMN1; SMN2LMNAALDH1A1MAPK1
SCHEMBL21644656 0.75 SMN1; SMN2 (0.53) L3MBTL1CNR2KMT2ACYP1A2CYP2C19
SCHEMBL5452520 0.75 CNR2 (0.84) CNR2CYP1A2CYP2C19SMN1; SMN2POLB
SCHEMBL16340385 0.74 L3MBTL1 (0.57) L3MBTL1KMT2ACYP1A2CYP2C19SMN1; SMN2
SCHEMBL2735040 0.74 KMT2A (0.87) L3MBTL1KMT2ACYP1A2CYP2C19SMN1; SMN2
SCHEMBL5083535 0.74 CNR2 (0.51) CNR2CYP1A2CYP2C19KDM4EALDH1A1

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-20080132505-A1 Combination Of Cb2 Modulators And Pde4 Inhibitors For Use In Medicine GLAXO GROUP LIMITED 2008-06-05 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-20080132505-A1 Combination Of Cb2 Modulators And Pde4 Inhibitors For Use In Medicine CNR2, CNR1, PDE4A L3MBTL1 4731/4885CNR2 1/4885KMT2A 2846/4885

“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.