SCHEMBL2242299

SCHEMBL2242299

CC(C)C(=O)Nc1ccc2nc(-c3ccc(Cl)cc3)oc2c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 5/20 0.75
▸ SENP7 Q9BQF6 4/20 0.75
▸ NPC1 O15118 8/20 0.67
▸ RAB9A P51151 8/20 0.67
▸ ALDH1A1 P00352 6/20 0.67
▸ SMN1; SMN2 Q16637 5/20 0.67
▸ HSD17B10 Q99714 4/20 0.67
▸ KDM4E B2RXH2 4/20 0.67
▸ KMT2A Q03164 2/20 0.67
▸ HPGD P15428 3/20 0.66
▸ TP53 P04637 3/20 0.66
▸ GAA P10253 2/20 0.66
▸ THRB P10828 1/20 0.66
▸ TSHR P16473 1/20 0.66
▸ NPSR1 Q6W5P4 1/20 0.66
▸ MEN1 O00255 1/20 0.64
▸ USP2 O75604 2/20 0.60
▸ LMNA P02545 2/20 0.60
▸ MAPK1 P28482 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60

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
SCHEMBL2249425 0.93 CASP3 (0.83) CASP3SENP7NPC1RAB9AALDH1A1
SCHEMBL24106598 0.92 CASP3 (0.81) CASP3SENP7NPC1RAB9AALDH1A1
SCHEMBL30965448 0.92 CASP3 (0.81) CASP3SENP7NPC1RAB9AALDH1A1
SCHEMBL2243398 0.91 CASP3 (0.87) CASP3SENP7NPC1RAB9AALDH1A1
SCHEMBL2243404 0.88 CASP3 (0.62) CASP3SENP7NPC1RAB9AALDH1A1
SCHEMBL2245760 0.86 CASP3 (1.00) CASP3SENP7NPC1RAB9AALDH1A1
SCHEMBL2250007 0.84 NPC1 (0.76) CASP3SENP7NPC1RAB9AALDH1A1
SCHEMBL2249434 0.82 CASP3 (0.67) CASP3SENP7NPC1RAB9AALDH1A1
SCHEMBL3182424 0.81 NPC1 (0.64) CASP3SENP7NPC1RAB9AKMT2A
SCHEMBL2249417 0.81 KDM4E (0.69) CASP3SENP7NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1986633-B1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORP PLC (GB) 2014-07-30 — — EP claimed
US-20110195932-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy SUMMIT (OXFORD) LIMITED (GB) 2011-08-11 — — US claimed
EP-3251694-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY Summit (Oxford) Limited (GB) 2017-12-06 — — EP disclosed
EP-1986633-B1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORP PLC (GB) 2014-07-30 — — EP disclosed
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2014-01-16 — — US disclosed
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2014-01-09 — — US disclosed
US-8518980-B2 Treatment of Duchenne muscular dystrophy SUMMIT CORPORATION PLC (GB) 2013-08-27 — — US disclosed
US-8501713-B2 Drug combinations for the treatment of duchenne muscular dystrophy SUMMIT CORPORATION PLC (GB) 2013-08-06 — — US disclosed
US-20110195932-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy SUMMIT (OXFORD) LIMITED (GB) 2011-08-11 — — US disclosed
US-20090075938-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT (OXFORD) LIMITED (GB) 2009-03-19 — — US disclosed
EP-1986633-A2 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY Summit Corporation Plc (GB) 2008-11-05 — — EP disclosed
WO-2007091106-A2 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2007-08-16 — — 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 (4 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-20110195932-A1 Drug Combinations for the Treatment of Duchenne Muscular Dystrophy PYGM, CPT1B, GYS1 CASP3 4141/4885SENP7 2647/4885NPC1 2477/4885
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY PYGM, CPT1B, GYS1 CASP3 4141/4885SENP7 2647/4885NPC1 2477/4885
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 CASP3 2481/4885SENP7 4246/4885NPC1 3637/4885
US-20090075938-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 CASP3 2481/4885SENP7 4246/4885NPC1 3637/4885

“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.

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