SCHEMBL4253237

SCHEMBL4253237

COc1cccc(Oc2ccc(C(=O)Cl)cn2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
KDM4E B2RXH2 2/20 0.59
ALDH1A1 P00352 2/20 0.59
BRCA1 P38398 1/20 0.59
HBB P68871 1/20 0.59
HSD17B10 Q99714 1/20 0.59
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
MAPK1 P28482 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HRH3 Q9Y5N1 3/20 0.47
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
KCNQ3 O43525 1/20 0.44
KCNQ2 O43526 1/20 0.44
NNMT P40261 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
SCHEMBL4254797 0.87 KDM4E (0.61) MEN1KMT2AKDM4EALDH1A1BRCA1
SCHEMBL5529678 0.86 KDM4E (0.63) MEN1KMT2AKDM4EALDH1A1BRCA1
SCHEMBL30737388 0.86 CHEK2 (0.45) MEN1KMT2AKDM4EALDH1A1BRCA1
SCHEMBL4253033 0.83 HRH3 (0.54) KMT2AALDH1A1GAAL3MBTL1HRH3
SCHEMBL3645651 0.82 HRH3 (0.53) HRH3KCNQ3KCNQ2LIPE
SCHEMBL4257593 0.82 PDE4B (0.56) MEN1KMT2AKDM4EALDH1A1BRCA1
SCHEMBL30737317 0.82 F10 (0.52) MEN1KMT2AALDH1A1GAAMAPT
Hydrochloric Acid SCHEMBL4254469 0.80 OPRM1 (0.45) ALDH1A1HRH3HTTNPSR1
SCHEMBL2154730 0.78 NNMT (0.68) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL4257164 0.77 NNMT (0.50) MEN1KMT2AMAPTL3MBTL1HRH3

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 MEN1 4409/4885KMT2A 2861/4885KDM4E 4227/4885

“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.