SCHEMBL8925244

SCHEMBL8925244

O=C(Nc1ccc(Oc2ccc(CC(O)C(=O)N3CCN(Cc4ccc5c(c4)OCO5)CC3)cc2)nc1)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.46
PRKAA2 P54646 1/20 0.46
NPC1 O15118 2/20 0.45
LMNA P02545 2/20 0.45
MAPK1 P28482 2/20 0.45
USP2 O75604 1/20 0.45
TP53 P04637 1/20 0.45
HIF1A Q16665 4/20 0.45
EPAS1 Q99814 4/20 0.45
RAB9A P51151 2/20 0.44
TNF P01375 1/20 0.44
NOD1 Q9Y239 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HPGD P15428 1/20 0.44
FLT1 P17948 1/20 0.43
KDR P35968 1/20 0.43
LIPE Q05469 1/20 0.43

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
SCHEMBL8925146 0.88 FAAH (0.47) FAAHPRKAA2NPC1LMNAMAPK1
SCHEMBL3032985 0.88 FAAH (0.47) FAAHPRKAA2NPC1LMNAMAPK1
SCHEMBL3137365 0.87 PRKAA2 (0.56) FAAHPRKAA2USP2HIF1AEPAS1
SCHEMBL12276572 0.86 NPC1 (0.47) FAAHPRKAA2NPC1LMNAMAPK1
SCHEMBL3032242 0.86 KDM4E (0.48) FAAHPRKAA2NPC1LMNAMAPK1
SCHEMBL3031904 0.86 MAPT (0.47) FAAHPRKAA2NPC1LMNAMAPK1
SCHEMBL4716251 0.84 L3MBTL1 (0.53) PRKAA2NPC1MAPK1HIF1AEPAS1
SCHEMBL3032236 0.84 LMNA (0.52) FAAHPRKAA2NPC1LMNAHIF1A
SCHEMBL3033606 0.83 CYP3A4 (0.43) FAAHPRKAA2NPC1LMNAMAPK1
SCHEMBL15295439 0.82 STAT3 (0.55) PRKAA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120238750-A1 AROMATIC COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2012-09-20 US disclosed
US-8236826-B2 Diarylether derivatives as antitumor agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-08-07 US disclosed
US-8236826-B2 Diarylether derivatives as antitumor agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-08-07 US disclosed
US-8188277-B2 Aromatic compounds for suppressing the generation of collagen OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-05-29 US disclosed
US-8188277-B2 Aromatic compounds for suppressing the generation of collagen OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-05-29 US disclosed
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-01-07 US disclosed
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-01-07 US disclosed
US-20070270422-A1 Aromatic Compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-11-22 US disclosed
US-20070270422-A1 Aromatic Compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-11-22 US 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 (3 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-20120238750-A1 AROMATIC COMPOUND CBR1, CBR3, CYP1A1 FAAH 2018/4885PRKAA2 4793/4885NPC1 1029/4885
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS ROS1, CBR1, CBR3 FAAH 1015/4885PRKAA2 4098/4885NPC1 1397/4885
US-20070270422-A1 Aromatic Compounds COL1A1, COL2A1, COL14A1 FAAH 2289/4885PRKAA2 4856/4885NPC1 2588/4885

“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.