SCHEMBL2244458

SCHEMBL2244458

O=C(Nc1ccc2oc(-c3ccc(F)cc3)nc2c1)c1ccco1

nearest known ligand 0.82

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.82
RAB9A P51151 9/20 0.82
SMN1; SMN2 Q16637 8/20 0.82
NPC1 O15118 7/20 0.82
HPGD P15428 7/20 0.82
TDP1 Q9NUW8 2/20 0.78
POLB P06746 2/20 0.78
MAPT P10636 14/20 0.72
ALDH1A1 P00352 8/20 0.72
HSD17B10 Q99714 4/20 0.69
TP53 P04637 4/20 0.69
NPSR1 Q6W5P4 1/20 0.68
APEX1 P27695 1/20 0.64
THRB P10828 1/20 0.61
GAA P10253 2/20 0.59
MEN1 O00255 1/20 0.59
HTT P42858 1/20 0.59
KMT2A Q03164 1/20 0.59
RXFP1 Q9HBX9 1/20 0.58

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
SCHEMBL2242570 0.90 RAB9A (1.00) KDM4ERAB9ASMN1; SMN2NPC1HPGD
SCHEMBL2243578 0.89 NPC1 (0.82) KDM4ERAB9ASMN1; SMN2NPC1HPGD
SCHEMBL2246978 0.89 RAB9A (0.82) KDM4ERAB9ASMN1; SMN2NPC1HPGD
SCHEMBL2246514 0.89 POLB (0.77) KDM4ERAB9ASMN1; SMN2NPC1HPGD
SCHEMBL2244913 0.86 RAB9A (0.77) KDM4ERAB9ASMN1; SMN2NPC1HPGD
SCHEMBL2246906 0.83 MAPT (1.00) KDM4ERAB9ASMN1; SMN2NPC1HPGD
SCHEMBL2244745 0.81 MAPT (0.87) KDM4ERAB9ASMN1; SMN2NPC1HPGD
SCHEMBL14825091 0.80 MAPT (0.77) KDM4ERAB9ASMN1; SMN2NPC1HPGD
SCHEMBL10143958 0.80 MAPT (0.80) KDM4ERAB9ASMN1; SMN2NPC1HPGD
SCHEMBL8019090 0.79 RAB9A (0.69) KDM4ERAB9ASMN1; SMN2NPC1HPGD

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 11 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-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 KDM4E 3311/4885RAB9A 3748/4885SMN1; SMN2 4/4885
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY PYGM, CPT1B, GYS1 KDM4E 3311/4885RAB9A 3748/4885SMN1; SMN2 4/4885
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 KDM4E 2080/4885RAB9A 4325/4885SMN1; SMN2 9/4885
US-20090075938-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 KDM4E 2080/4885RAB9A 4325/4885SMN1; SMN2 9/4885

“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.