SCHEMBL4128318

SCHEMBL4128318

COC(=O)/C=C/c1cccn1-c1c(F)cc(Cl)cc1C(O)c1cccc(OC)c1OC

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
BCHE P06276 1/20 0.35
FDFT1 P37268 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ATM Q13315 1/20 0.34
KRAS P01116 2/20 0.33
NFE2L2 Q16236 2/20 0.33
PDE4B Q07343 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NR1H4 Q96RI1 2/20 0.33

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
SCHEMBL4128321 1.00 ALDH1A1 (0.35) ALDH1A1MAPTBCHEFDFT1MEN1
SCHEMBL13775240 0.86 FDFT1 (0.39) ALDH1A1MAPTFDFT1NFE2L2L3MBTL1
SCHEMBL13775256 0.83 ALDH1A1 (0.39) ALDH1A1MAPTFDFT1MEN1KMT2A
SCHEMBL4127985 0.82 RAB9A (0.36) ALDH1A1BCHEMEN1KMT2AKRAS
SCHEMBL4127982 0.82 RAB9A (0.36) ALDH1A1BCHEMEN1KMT2AKRAS
SCHEMBL13775454 0.82 KDM4E (0.34) ALDH1A1MAPTBCHEFDFT1KRAS
SCHEMBL13775457 0.80 NR1H4 (0.36) ALDH1A1NFE2L2KDM4ENR1H4
SCHEMBL4123855 0.80 FDFT1 (0.37) ALDH1A1MAPTFDFT1NFE2L2L3MBTL1
SCHEMBL4123861 0.80 FDFT1 (0.37) ALDH1A1MAPTFDFT1NFE2L2L3MBTL1
SCHEMBL13775445 0.80 GAA (0.40) ALDH1A1MAPTFDFT1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
EP-1939205-A1 TRICYCLIC COMPOUND Daiichi Sankyo Company, Limited (JP) 2008-07-02 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-20090181942-A1 TRICYCLIC COMPOUNDS FDFT1, COASY, HMGCR ALDH1A1 1587/4885MAPT 4428/4885BCHE 201/4885

“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.