SCHEMBL2245161

SCHEMBL2245161

Cc1ccc2oc(-c3ccc(Cl)c(N)c3)nc2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.66
ALDH1A1 P00352 11/20 0.66
SMN1; SMN2 Q16637 11/20 0.66
KDM4E B2RXH2 10/20 0.66
NPC1 O15118 10/20 0.66
HPGD P15428 10/20 0.66
TP53 P04637 6/20 0.66
HSD17B10 Q99714 6/20 0.66
MAPT P10636 7/20 0.63
NFKB1 P19838 5/20 0.63
NFKB2 Q00653 5/20 0.63
RELA Q04206 5/20 0.63
L3MBTL1 Q9Y468 3/20 0.59
LMNA P02545 1/20 0.59
CASP3 P42574 3/20 0.58
SENP8 Q96LD8 3/20 0.58
SENP7 Q9BQF6 3/20 0.58
SENP6 Q9GZR1 3/20 0.58
POLB P06746 1/20 0.58
ALOX5 P09917 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
SCHEMBL2491813 0.86 RAB9A (0.69) RAB9AALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL14513131 0.86 KDM4E (0.69) RAB9AALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL12643200 0.83 RAB9A (0.69) RAB9AALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL5834420 0.82 SMN1; SMN2 (0.57) RAB9AALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL14947173 0.82 ALDH1A1 (0.96) RAB9AALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL31631311 0.81 NPC1 (0.64) RAB9AALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL13265933 0.81 KDM4E (0.62) RAB9AALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL13171393 0.81 ALOX5 (0.78) RAB9AALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL13240431 0.81 SMN1; SMN2 (0.62) RAB9AALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL474369 0.81 RAB9A (0.82) RAB9AALDH1A1SMN1; SMN2KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 RAB9A 3748/4885ALDH1A1 1203/4885SMN1; SMN2 4/4885
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY PYGM, CPT1B, GYS1 RAB9A 3748/4885ALDH1A1 1203/4885SMN1; SMN2 4/4885
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 RAB9A 4325/4885ALDH1A1 1652/4885SMN1; SMN2 9/4885
US-20090075938-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 RAB9A 4325/4885ALDH1A1 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.