SCHEMBL6566874

SCHEMBL6566874

CC(=O)Oc1ccc2c(c1)Oc1ccccc1C2N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
CYP2C9 P11712 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
NR3C1 P04150 1/20 0.47
ALDH1A1 P00352 3/20 0.46
MAPT P10636 3/20 0.46
KMT2A Q03164 3/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 2/20 0.46
USP2 O75604 1/20 0.46
HTT P42858 1/20 0.46
CYP3A4 P08684 1/20 0.43
ATM Q13315 1/20 0.43
FLT3 P36888 1/20 0.43
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
KDM4E B2RXH2 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
SMN1; SMN2 Q16637 1/20 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
SCHEMBL12205513 0.84 NR3C1 (0.54) L3MBTL1CYP2C9CYP1A2CYP2C19NR3C1
SCHEMBL2952247 0.81 CA2 (0.50) ALDH1A1MAPTKMT2ALMNAMEN1
SCHEMBL29438813 0.80 CYP2C9 (0.61) L3MBTL1CYP2C9CYP1A2CYP2C19NR3C1
SCHEMBL27694186 0.78 L3MBTL1 (0.45) L3MBTL1CYP2C9CYP1A2CYP2C19ALDH1A1
SCHEMBL18648400 0.77 L3MBTL1 (0.43) L3MBTL1CYP2C9CYP1A2CYP2C19NR3C1
SCHEMBL16450352 0.77 CYP3A4 (0.43) L3MBTL1NR3C1MAPTKMT2ALMNA
SCHEMBL29326329 0.75 L3MBTL1 (0.44) L3MBTL1CYP2C9CYP1A2CYP2C19ALDH1A1
SCHEMBL15237264 0.75 GAA (0.56) NR3C1ALDH1A1MAPTKMT2AMEN1
SCHEMBL29413779 0.73 MAOA (0.58) CYP2C9NR3C1MAPTKMT2ALMNA
SCHEMBL88261 0.73 MAOA (0.58) CYP2C9NR3C1MAPTKMT2ALMNA

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-20040242854-A1 Chemical capture reagent GE HEALTHCARE UK LIMITED (GB) 2004-12-02 US claimed
EP-1402268-A2 CHEMICAL CAPTURE REAGENT Amersham Biosciences UK Limited (GB) 2004-03-31 EP claimed
WO-2003005026-A2 CHEMICAL CAPTURE REAGENT AMERSHAM BIOSCIENCES UK LIMITED (GB) 2003-01-16 WO 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-20040242854-A1 Chemical capture reagent SPPL2B, PRXL2A, PLG L3MBTL1 3390/4885CYP2C9 1632/4885CYP1A2 2147/4885

“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.