SCHEMBL2244763

SCHEMBL2244763

CC(C)(C)OC(=O)NCCC(=O)Nc1ccc2oc(-c3ccccc3)nc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.59
KDM4E B2RXH2 11/20 0.59
SMN1; SMN2 Q16637 7/20 0.59
RAB9A P51151 5/20 0.59
POLB P06746 4/20 0.59
NPC1 O15118 4/20 0.59
KDR P35968 2/20 0.56
HPGD P15428 10/20 0.56
HSD17B10 Q99714 8/20 0.56
CHIA Q9BZP6 1/20 0.56
MAPT P10636 4/20 0.55
NPSR1 Q6W5P4 1/20 0.55
PPARG P37231 1/20 0.54
NR2E3 Q9Y5X4 1/20 0.54
NCOR2 Q9Y618 1/20 0.54
GLA P06280 1/20 0.53
TP53 P04637 3/20 0.52
CASP3 P42574 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52

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) ALDH1A1KDM4ESMN1; SMN2RAB9APOLB
SCHEMBL2242703 0.79 KDM4E (0.82) ALDH1A1KDM4ESMN1; SMN2RAB9APOLB
SCHEMBL2240780 0.79 CHIA (0.79) ALDH1A1KDM4ESMN1; SMN2RAB9APOLB
SCHEMBL4758298 0.79 CA1 (0.57) ALDH1A1SMN1; SMN2RAB9APOLBNPC1
SCHEMBL2249447 0.78 ALDH1A1 (0.61) ALDH1A1KDM4ESMN1; SMN2RAB9APOLB
SCHEMBL2242972 0.78 ALDH1A1 (0.69) ALDH1A1KDM4ESMN1; SMN2RAB9APOLB
SCHEMBL29479738 0.77 ALDH1A1 (0.64) ALDH1A1KDM4ESMN1; SMN2RAB9APOLB
SCHEMBL30782729 0.77 PPARG (0.67) ALDH1A1KDM4ESMN1; SMN2RAB9APOLB
SCHEMBL2607551 0.77 NPC1 (0.75) ALDH1A1KDM4ESMN1; SMN2RAB9APOLB
SCHEMBL6274441 0.76 CA1 (0.58) ALDH1A1SMN1; SMN2HPGDMAPT

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 8 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-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 ALDH1A1 1203/4885KDM4E 3311/4885SMN1; SMN2 4/4885
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY PYGM, CPT1B, GYS1 ALDH1A1 1203/4885KDM4E 3311/4885SMN1; SMN2 4/4885
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 ALDH1A1 1652/4885KDM4E 2080/4885SMN1; SMN2 9/4885
US-20090075938-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 ALDH1A1 1652/4885KDM4E 2080/4885SMN1; 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.