SCHEMBL15564276

SCHEMBL15564276

COc1nc2ccccc2cc1C(=O)CN

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 1/20 0.45
PPARD Q03181 1/20 0.44
PPARA Q07869 1/20 0.44
HDAC6 Q9UBN7 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
TLR8 Q9NR97 1/20 0.43
BTK Q06187 1/20 0.43
KDM4E B2RXH2 6/20 0.43
ALDH1A1 P00352 4/20 0.41
GAA P10253 3/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.40
CNR2 P34972 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL15671177 0.87 PPARD (0.45) IKBKBPPARDPPARAHDAC6L3MBTL1
SCHEMBL4432713 0.83 IKBKB (0.61) IKBKBPPARDPPARAHDAC6L3MBTL1
SCHEMBL29934771 0.83 IKBKB (0.61) IKBKBPPARDPPARAHDAC6L3MBTL1
SCHEMBL15563826 0.82 ALDH1A1 (0.52) IKBKBPPARDPPARAHDAC6L3MBTL1
SCHEMBL3715949 0.81 KDM4E (0.56) IKBKBPPARDPPARAHDAC6L3MBTL1
SCHEMBL22263501 0.81 PPARD (0.47) IKBKBPPARDPPARAHDAC6L3MBTL1
SCHEMBL31423348 0.81 KDM4E (0.56) IKBKBPPARDPPARAHDAC6L3MBTL1
SCHEMBL15563981 0.81 PPARD (0.46) PPARDPPARAHDAC6L3MBTL1SMN1; SMN2
SCHEMBL6603045 0.80 KDM4E (0.51) IKBKBPPARDPPARASMN1; SMN2MAPT
SCHEMBL6601700 0.78 ALDH1A1 (0.54) PPARDPPARAL3MBTL1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2882724-B1 COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS THAT ARE AMELIORATED BY INHIBITION OF HDAC IRBM - SCIENCE PARK S P A (IT) 2017-11-01 EP disclosed
EP-2914589-B1 COMPOUNDS FOR USE IN THE TREATMENT OF PARASITIC DISEASES IRBM - SCIENCE PARK S P A (IT) 2017-08-30 EP disclosed
EP-2914589-B1 COMPOUNDS FOR USE IN THE TREATMENT OF PARASITIC DISEASES IRBM - SCIENCE PARK S P A (IT) 2017-08-30 EP disclosed
US-9371295-B2 Compounds for use in the treatment of disorders that are ameliorated by inhibition of HDAC IRBM-SCIENCE PARK S.P.A. (IT) 2016-06-21 US disclosed
US-9365541-B2 Compounds for use in the treatment of parasitic diseases IRBM—SCIENCE PARK S.P.A. (IT) 2016-06-14 US disclosed
US-9365541-B2 Compounds for use in the treatment of parasitic diseases IRBM—SCIENCE PARK S.P.A. (IT) 2016-06-14 US disclosed
US-9365541-B2 Compounds for use in the treatment of parasitic diseases IRBM—SCIENCE PARK S.P.A. (IT) 2016-06-14 US disclosed
US-20150299163-A1 COMPOUNDS FOR USE IN THE TREATMENT OF PARASITIC DISEASES IRBM - SCIENCE PARK S.P.A. (IT) 2015-10-22 US disclosed
US-20150299163-A1 COMPOUNDS FOR USE IN THE TREATMENT OF PARASITIC DISEASES IRBM - SCIENCE PARK S.P.A. (IT) 2015-10-22 US disclosed
US-20150299163-A1 COMPOUNDS FOR USE IN THE TREATMENT OF PARASITIC DISEASES IRBM - SCIENCE PARK S.P.A. (IT) 2015-10-22 US disclosed
EP-2914589-A1 COMPOUNDS FOR USE IN THE TREATMENT OF PARASITIC DISEASES IRBM - Science Park S.p.A. (IT) 2015-09-09 EP disclosed
US-20150218112-A1 COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS THAT ARE AMELIORATED BY INHIBITION OF HDAC IRBM - SCIENCE PARK S.P.A. (IT) 2015-08-06 US disclosed
EP-2882724-A1 COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS THAT ARE AMELIORATED BY INHIBITION OF HDAC IRBM - Science Park S.p.A. (IT) 2015-06-17 EP disclosed
WO-2014067985-A1 COMPOUNDS FOR USE IN THE TREATMENT OF PARASITIC DISEASES IRBM SCIENCE PARK S.P.A. (IT) 2014-05-08 WO disclosed
WO-2014067985-A1 COMPOUNDS FOR USE IN THE TREATMENT OF PARASITIC DISEASES IRBM SCIENCE PARK S.P.A. (IT) 2014-05-08 WO disclosed
WO-2014023754-A1 COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS THAT ARE AMELIORATED BY INHIBITION OF HDAC IRBM - SCIENCE PARK S.P.A. (IT) 2014-02-13 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-20150299163-A1 COMPOUNDS FOR USE IN THE TREATMENT OF PARASITIC DISEASES HDAC3, HDAC5, HDAC1 IKBKB 1997/4885PPARD 448/4885PPARA 746/4885
US-20150218112-A1 COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS THAT ARE AMELIORATED BY INHIBITION OF HDAC HDAC5, HDAC4, HDAC6 IKBKB 199/4885PPARD 1555/4885PPARA 1626/4885

“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.