SCHEMBL5907211

SCHEMBL5907211

C=CCOc1cccn(Cc2ccccc2)c1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.53
BRD4 O60885 2/20 0.47
BRD2 P25440 1/20 0.47
BRD3 Q15059 1/20 0.47
BRDT Q58F21 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
MAPT P10636 2/20 0.46
RAB9A P51151 1/20 0.46
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
ALOX15 P16050 1/20 0.42
KDM4E B2RXH2 2/20 0.41
HTT P42858 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CNR1 P21554 2/20 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
SCHEMBL271730 0.82 MAPK14 (0.68) MAPK14BRD4BRD2BRD3BRDT
SCHEMBL14324139 0.77 LMNA (0.57) MAPK14BRD4BRD2BRD3BRDT
SCHEMBL14470357 0.77 MAPK14 (0.51) MAPK14BRD4BRD2BRD3BRDT
SCHEMBL5907210 0.72 MAPK14 (0.45) MAPK14SMN1; SMN2MAPTCYP3A4CYP2C19
1,2-Diallyloxybenzene SCHEMBL366516 0.70 HPGD (0.60) MAPTCYP3A4KDM4EALDH1A1LMNA
1,2-Diallyloxybenzene SCHEMBL29768784 0.70 HPGD (0.60) MAPTCYP3A4KDM4EALDH1A1LMNA
SCHEMBL12635299 0.70 MAPK1 (0.53) MAPK14SMN1; SMN2MAPTRAB9AALOX15
SCHEMBL15804049 0.70 BRD4 (0.54) MAPK14BRD4BRD2BRD3BRDT
SCHEMBL29001250 0.70 LMNA (0.58) MAPK14BRD4BRD2BRD3BRDT
1,2-Diallyloxybenzene SCHEMBL11629869 0.70 TSHR (0.49) SMN1; SMN2CYP3A4ALOX15KDM4EALDH1A1

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-20060106044-A1 Methods for inhibiting the transmission of HIV using topically applied substituted 6-benzyl-4-oxopyrimidines IDENIX PHARMACEUTICALS INC. (US) 2006-05-18 US claimed

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-20060106044-A1 Methods for inhibiting the transmission of HIV using topically applied substituted 6-benzyl-4-oxopyrimidines DUT, UNG, NUDT1 MAPK14 2241/4885BRD4 875/4885BRD2 1537/4885

“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.