SCHEMBL2245235

SCHEMBL2245235

Cc1ccc(-c2nc3cc(NC(=O)C(C)C)ccc3[nH]2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.58
ALDH1A1 P00352 6/20 0.58
NPC1 O15118 5/20 0.58
RAB9A P51151 5/20 0.58
HPGD P15428 4/20 0.58
HSD17B10 Q99714 3/20 0.58
TP53 P04637 2/20 0.58
GAA P10253 2/20 0.58
THRB P10828 1/20 0.58
TSHR P16473 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
EGFR P00533 1/20 0.57
HPSE Q9Y251 3/20 0.56
NR2E3 Q9Y5X4 1/20 0.56
KDM4E B2RXH2 4/20 0.52
KMT2A Q03164 3/20 0.52
LMNA P02545 2/20 0.52
MEN1 O00255 2/20 0.52
KDR P35968 1/20 0.51
MMP2 P08253 2/20 0.50

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
SCHEMBL27202548 0.93 HPSE (0.62) SMN1; SMN2ALDH1A1NPC1RAB9AHPGD
SCHEMBL2242549 0.89 NR2E3 (0.60) SMN1; SMN2ALDH1A1RAB9AHPGDHSD17B10
SCHEMBL2242067 0.89 NR2E3 (0.60) SMN1; SMN2ALDH1A1NPC1RAB9AHPGD
SCHEMBL25606519 0.85 EGFR (0.51) SMN1; SMN2ALDH1A1NPC1RAB9AHPGD
SCHEMBL13420244 0.81 EGFR (0.54) SMN1; SMN2ALDH1A1NPC1RAB9AHPGD
SCHEMBL2245599 0.81 EGFR (0.64) SMN1; SMN2ALDH1A1NPC1RAB9AHPGD
SCHEMBL20982455 0.80 ALDH1A1 (0.67) SMN1; SMN2ALDH1A1NPC1RAB9AHPGD
SCHEMBL6529301 0.80 HPSE (0.81) SMN1; SMN2ALDH1A1NPC1RAB9AHPGD
SCHEMBL20982497 0.79 ALDH1A1 (0.66) SMN1; SMN2ALDH1A1NPC1RAB9AHPGD
SCHEMBL29056577 0.79 HPSE (0.52) SMN1; SMN2ALDH1A1NPC1RAB9AHPGD

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
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
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
CN-101678107-A Pharmaceutical composition for treating Duchenne muscular dystrophy SUMMIT CORP PLC 2010-03-24 CN 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 SMN1; SMN2 4/4885ALDH1A1 1203/4885NPC1 2477/4885
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY PYGM, CPT1B, GYS1 SMN1; SMN2 4/4885ALDH1A1 1203/4885NPC1 2477/4885
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 SMN1; SMN2 9/4885ALDH1A1 1652/4885NPC1 3637/4885
US-20090075938-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 SMN1; SMN2 9/4885ALDH1A1 1652/4885NPC1 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.