SCHEMBL3142673

SCHEMBL3142673

CCOC(=O)CCc1ccc(Oc2ccc(NC(=O)N(CC)c3ccc(Cl)c(Cl)c3)cn2)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
P2RX3 P56373 10/20 0.40
CETP P11597 2/20 0.40
GFER P55789 1/20 0.37
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
MLNR O43193 1/20 0.36
CYP4Z1 Q86W10 1/20 0.36
ACACB O00763 1/20 0.35

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
SCHEMBL3147539 0.84 P2RX3 (0.46) SMN1; SMN2P2RX3CYP4F2CYP4A11
SCHEMBL3134816 0.82 FFAR1 (0.50) SMN1; SMN2P2RX3CYP4F2CYP4A11
SCHEMBL3147138 0.81 P2RX3 (0.44) SMN1; SMN2P2RX3CYP4F2CYP4A11ACACB
SCHEMBL3146712 0.80 CYP4F2 (0.40) SMN1; SMN2P2RX3CYP4F2CYP4A11CYP4Z1
SCHEMBL3137193 0.79 KCNQ3 (0.47) SMN1; SMN2P2RX3
SCHEMBL3142629 0.77 CYP4F2 (0.48) P2RX3GFERCYP4F2CYP4A11CYP4Z1
SCHEMBL3147179 0.75 RAB9A (0.49) P2RX3GFERACACB
SCHEMBL8913031 0.74 CYP4F2 (0.45) P2RX3GFERCYP4F2CYP4A11CYP4Z1
SCHEMBL3134853 0.74 NPC1 (0.48) ACACB
SCHEMBL3143459 0.73 KCNQ3 (0.48) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-01-07 US disclosed
EP-1957073-A2 MEDICINAL DRUG OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-08-20 EP disclosed
US-20070270422-A1 Aromatic Compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-11-22 US disclosed
WO-2007066784-A2 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-06-14 WO disclosed
EP-1773797-A2 AROMATIC COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-04-18 EP disclosed
WO-2006014012-A2 AROMATIC COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-02-09 WO 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 (2 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-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS ROS1, CBR1, CBR3 SMN1; SMN2 3224/4885P2RX3 2435/4885CETP 3905/4885
US-20070270422-A1 Aromatic Compounds COL1A1, COL2A1, COL14A1 SMN1; SMN2 3077/4885P2RX3 1097/4885CETP 3102/4885

“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.