SCHEMBL2248169

SCHEMBL2248169

O=C(Nc1ccc2oc(-c3ccc(C(F)(F)F)cc3)nc2c1)c1ccncc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.78
ALDH1A1 P00352 7/20 0.78
SMN1; SMN2 Q16637 5/20 0.78
POLB P06746 5/20 0.78
TSHR P16473 2/20 0.78
MAPK1 P28482 2/20 0.78
LMNA P02545 1/20 0.78
KDM4E B2RXH2 7/20 0.74
TDP1 Q9NUW8 3/20 0.74
APEX1 P27695 1/20 0.74
NPSR1 Q6W5P4 2/20 0.74
RXFP1 Q9HBX9 2/20 0.74
HSD17B10 Q99714 3/20 0.66
PPARG P37231 1/20 0.66
NCOA2 Q15596 1/20 0.66
NCOA1 Q15788 1/20 0.66
NCOA3 Q9Y6Q9 1/20 0.66
HDAC3 O15379 1/20 0.65
HDAC1 Q13547 1/20 0.65
HDAC2 Q92769 1/20 0.65

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
SCHEMBL2246094 0.90 ALDH1A1 (0.78) MAPTALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL2243162 0.89 MAPT (0.83) MAPTALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL2242829 0.89 MAPT (0.78) MAPTALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL2246106 0.88 MAPT (0.85) MAPTALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL2242881 0.88 MAPT (0.79) MAPTALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL2245519 0.87 ALDH1A1 (1.00) MAPTALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL2247024 0.86 MAPT (0.78) MAPTALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL2244953 0.85 NPC1 (0.72) MAPTALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL2242031 0.85 MAPT (0.74) MAPTALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL2242480 0.85 MAPT (0.88) MAPTALDH1A1SMN1; SMN2POLBTSHR

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 MAPT 3113/4885ALDH1A1 1203/4885SMN1; SMN2 4/4885
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY PYGM, CPT1B, GYS1 MAPT 3113/4885ALDH1A1 1203/4885SMN1; SMN2 4/4885
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 MAPT 4858/4885ALDH1A1 1652/4885SMN1; SMN2 9/4885
US-20090075938-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 MAPT 4858/4885ALDH1A1 1652/4885SMN1; 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.