SCHEMBL2244535

SCHEMBL2244535

O=C(CCN1CCOCC1)Nc1ccc2oc(-c3ccccc3)nc2c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP3 Q9Y6F1 1/20 0.76
LMNA P02545 3/20 0.60
CYP2C19 P33261 1/20 0.60
ALDH1A1 P00352 11/20 0.59
KDM4E B2RXH2 10/20 0.59
HPGD P15428 10/20 0.59
NPC1 O15118 7/20 0.59
HSD17B10 Q99714 5/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
HTT P42858 1/20 0.59
SMN1; SMN2 Q16637 9/20 0.58
RAB9A P51151 6/20 0.58
POLB P06746 5/20 0.58
MAPT P10636 5/20 0.56
NPSR1 Q6W5P4 2/20 0.56
TSHR P16473 3/20 0.56
MAPK1 P28482 2/20 0.56
PPARG P37231 1/20 0.56
NR2E3 Q9Y5X4 1/20 0.56

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
SCHEMBL2246113 0.81 KDM4E (0.81) ALDH1A1KDM4EHPGDNPC1HSD17B10
SCHEMBL4042252 0.80 KDM4E (0.68) PARP3LMNAALDH1A1KDM4EHPGD
SCHEMBL2242972 0.80 ALDH1A1 (0.69) LMNAALDH1A1KDM4EHPGDNPC1
SCHEMBL2242703 0.79 KDM4E (0.82) ALDH1A1KDM4EHPGDNPC1HSD17B10
SCHEMBL2240780 0.78 CHIA (0.79) LMNAALDH1A1KDM4EHPGDNPC1
SCHEMBL2246316 0.77 ALDH1A1 (0.87) LMNAALDH1A1KDM4EHPGDNPC1
SCHEMBL13118343 0.76 LMNA (1.00) LMNACYP2C19ALDH1A1HPGDKMT2A
SCHEMBL2247199 0.76 MAPT (0.86) LMNAALDH1A1KDM4EHPGDNPC1
SCHEMBL19174171 0.76 ALDH1A1 (0.67) LMNAALDH1A1KDM4EHPGDNPC1
SCHEMBL19148989 0.75 ALDH1A1 (0.65) LMNAALDH1A1KDM4EHPGDNPC1

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 PARP3 1961/4885LMNA 260/4885CYP2C19 3317/4885
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY PYGM, CPT1B, GYS1 PARP3 1961/4885LMNA 260/4885CYP2C19 3317/4885
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 PARP3 2952/4885LMNA 2698/4885CYP2C19 3199/4885
US-20090075938-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 PARP3 2952/4885LMNA 2698/4885CYP2C19 3199/4885

“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.