SCHEMBL96330

SCHEMBL96330

[CH2]c1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.73
KCNK3 O14649 2/20 0.68
RXFP1 Q9HBX9 6/20 0.66
MEN1 O00255 5/20 0.65
KMT2A Q03164 5/20 0.65
LMNA P02545 2/20 0.65
RAB9A P51151 2/20 0.65
NPC1 O15118 1/20 0.65
PTGS1 P23219 2/20 0.63
MAOA P21397 1/20 0.63
MAOB P27338 1/20 0.63
P2RX1 P51575 1/20 0.62
TSHR P16473 1/20 0.61
HTT P42858 2/20 0.60
POLB P06746 1/20 0.60
GAA P10253 1/20 0.59
MAPK1 P28482 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
KCNK9 Q9NPC2 1/20 0.59

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
SCHEMBL24141032 0.92 MAPT (0.84) MAPTKCNK3RXFP1MEN1KMT2A
SCHEMBL23447711 0.91 MAPT (0.82) MAPTKCNK3RXFP1MEN1KMT2A
SCHEMBL30447521 0.87 MAPT (0.75) MAPTKCNK3RXFP1MEN1KMT2A
SCHEMBL5313393 0.87 MAPT (0.75) MAPTKCNK3RXFP1MEN1KMT2A
SCHEMBL8461120 0.87 MAPT (0.75) MAPTKCNK3RXFP1MEN1KMT2A
SCHEMBL7816780 0.87 MEN1 (0.76) MAPTKCNK3RXFP1MEN1KMT2A
SCHEMBL4683413 0.86 KCNK3 (0.88) MAPTKCNK3RXFP1MEN1KMT2A
SCHEMBL11307930 0.85 PTGS1 (0.76) MAPTKCNK3RXFP1MEN1KMT2A
SCHEMBL22066205 0.85 RXFP1 (0.79) MAPTKCNK3RXFP1MEN1KMT2A
SCHEMBL95209 0.85 LMNA (0.76) MAPTKCNK3RXFP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362252-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-29 US disclosed
EP-1797082-B1 CARBOSTYRIL COMPOUND OTSUKA PHARMA CO LTD (JP) 2012-08-29 EP disclosed
EP-2426128-A1 Carbostyril compound Otsuka Pharmaceutical Co., Limited (JP) 2012-03-07 EP disclosed
US-20100261705-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2010-10-14 US disclosed
US-7777038-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-08-17 US disclosed
US-20090326008-A1 NF-kappa B Inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-12-31 US disclosed
CN-101489555-A Nf-kappa OTSUKA PHARMA CO LTD (JP) 2009-07-22 CN disclosed
EP-2043644-A1 NF- B INHIBITOR Otsuka Pharmaceutical Co., Ltd. (JP) 2009-04-08 EP disclosed
WO-2008010601-A1 NF- ϰB INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-01-24 WO disclosed
WO-2007119600-A1 CARBAZOLE COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-10-25 WO disclosed
US-20070179173-A1 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 US disclosed
EP-1797082-A1 CARBOSTYRIL COMPOUND Otsuka Pharmaceutical Company, Limited (JP) 2007-06-20 EP disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 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 (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-20090326008-A1 NF-kappa B Inhibitor NFKBIA, NFKB2, IKBKB MAPT 4112/4885KCNK3 2967/4885RXFP1 2633/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 MAPT 4773/4885KCNK3 3229/4885RXFP1 125/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 MAPT 4773/4885KCNK3 3229/4885RXFP1 125/4885

“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.