SCHEMBL4258650

SCHEMBL4258650

CCOC(=O)c1ccc(Oc2ccccc2OC)nc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
CYP1A2 P05177 2/20 0.53
CYP3A4 P08684 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.49
HSD17B2 P37059 1/20 0.48
PDE4B Q07343 1/20 0.47
PDGFRB P09619 1/20 0.46
PDGFRA P16234 1/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
HTT P42858 1/20 0.46
NNMT P40261 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL4259564 0.87 PDGFRB (0.50) MAPTHSD17B2PDE4BPDGFRBPDGFRA
SCHEMBL4257880 0.86 KMT2A (0.51) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL4250576 0.84 PDE4B (0.45) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL18609609 0.84 PDE4B (0.45) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL10972399 0.83 NNMT (0.60) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL18609606 0.83 HTT (0.51) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL2255952 0.82 PDE4B (0.56) MAPTCYP1A2CYP2C9CYP2C19L3MBTL1
SCHEMBL5528761 0.82 NNMT (0.69) L3MBTL1MEN1KMT2AHTTNNMT
SCHEMBL4255464 0.82 MAPT (0.54) MAPTL3MBTL1MEN1KMT2AHTT
SCHEMBL4257164 0.81 NNMT (0.50) MAPTL3MBTL1MEN1KMT2AHTT

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-20090239860-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-09-24 US disclosed
EP-1710233-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE Kissei Pharmaceutical Co., Ltd. (JP) 2006-10-11 EP 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-20090239860-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE ADORA2A, ADORA2B, HTR1F MAPT 4025/4885CYP1A2 495/4885CYP3A4 899/4885

“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.