SCHEMBL3147392

SCHEMBL3147392

CC(=O)N(c1ccc(CCC(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
HPGD P15428 1/20 0.46
LMNA P02545 9/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HTT P42858 3/20 0.46
MAPK1 P28482 2/20 0.45
ALDH1A1 P00352 5/20 0.44
POLB P06746 2/20 0.44
NPC1 O15118 2/20 0.43
USP2 O75604 1/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALOX12 P18054 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
FAAH O00519 2/20 0.43
CYP3A4 P08684 2/20 0.42
ABCB11 O95342 1/20 0.42
CYP1A2 P05177 1/20 0.42

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
SCHEMBL3142694 0.92 MEN1 (0.52) MEN1KMT2AHPGDLMNASMN1; SMN2
Oxalic Acid SCHEMBL3138538 0.90 MEN1 (0.48) MEN1KMT2AHPGDLMNASMN1; SMN2
SCHEMBL12276840 0.86 NPC1 (0.40) MEN1KMT2AHPGDLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL3142616 0.86 MEN1 (0.55) MEN1KMT2AHPGDLMNASMN1; SMN2
SCHEMBL3128870 0.85 MEN1 (0.56) MEN1KMT2AHPGDLMNASMN1; SMN2
SCHEMBL3133163 0.85 MEN1 (0.56) MEN1KMT2AHPGDLMNASMN1; SMN2
SCHEMBL3142686 0.84 MEN1 (0.54) MEN1KMT2AHPGDLMNASMN1; SMN2
SCHEMBL3031497 0.81 LMNA (0.47) MEN1KMT2AHPGDLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL3147149 0.81 MEN1 (0.59) MEN1KMT2AHPGDLMNASMN1; SMN2
SCHEMBL3020822 0.78 MEN1 (0.50) MEN1KMT2AHPGDLMNASMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957073-B1 MEDICINAL DRUG OTSUKA PHARMA CO LTD (JP) 2014-04-23 EP 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-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
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 MEN1 1851/4885KMT2A 1623/4885HPGD 733/4885
US-20070270422-A1 Aromatic Compounds COL1A1, COL2A1, COL14A1 MEN1 3512/4885KMT2A 2349/4885HPGD 1282/4885

“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.