SCHEMBL6092876

SCHEMBL6092876

COC(=O)c1ccc(CC(=O)c2c(OC)ccc(Br)c2OC)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.45
CYP2C19 P33261 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
LOXL2 Q9Y4K0 1/20 0.43
MAPK10 P53779 1/20 0.42
KMT2A Q03164 4/20 0.42
NPC1 O15118 2/20 0.42
LMNA P02545 2/20 0.42
HTT P42858 1/20 0.42
KDM4E B2RXH2 1/20 0.41
CCR6 P51684 1/20 0.41
HKDC1 Q2TB90 1/20 0.41
MEN1 O00255 3/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
CYP4A11 Q02928 2/20 0.40

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
SCHEMBL6091950 0.82 LMNA (0.53) MAPTCYP2C19SMN1; SMN2CYP1A2CYP3A4
SCHEMBL6093551 0.81 PIK3CA (0.42) MAPTCYP2C19SMN1; SMN2CYP3A4KMT2A
SCHEMBL4599128 0.80 MEN1 (0.47) MAPTCYP2C19SMN1; SMN2CYP3A4KMT2A
SCHEMBL6091905 0.80 LMNA (0.51) MAPTKMT2ALMNAHTTKDM4E
SCHEMBL6094177 0.78 MAPT (0.48) MAPTCYP2C19SMN1; SMN2CYP1A2CYP3A4
SCHEMBL6093199 0.76 LMNA (0.37) MAPTCYP2C19SMN1; SMN2KMT2ANPC1
SCHEMBL6093204 0.76 TDP1 (0.43) MAPTKMT2ARAB9AMAPK1
SCHEMBL2332389 0.75 SMN1; SMN2 (0.46) MAPTCYP2C19SMN1; SMN2CYP1A2CYP3A4
SCHEMBL6092756 0.75 TTR (0.48) MAPTSMN1; SMN2KMT2ANPC1LMNA
SCHEMBL6091945 0.74 MAPT (0.41) MAPTCYP2C19SMN1; SMN2KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060063828-A1 1,2-Bis-(substituted-phenyl)-2-propen-1-ones and pharmaceutical compositions thereof ATHEROGENICS, INC. 2006-03-23 US disclosed
WO-2006004903-A2 1,2-BIS-(SUBSTITUTED-PHENYL)-2-PROPEN-1-ONES AND PHARMACEUTICAL COMPOSITIONS THEREOF ATHEROGENICS, INC. (US) 2006-01-12 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-20060063828-A1 1,2-Bis-(substituted-phenyl)-2-propen-1-ones and pharmaceutical compositions thereof ABCB11, CEL, CYP46A1 MAPT 1784/4885CYP2C19 16/4885SMN1; SMN2 2250/4885

“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.