SCHEMBL2245331

SCHEMBL2245331

O=C(Nc1ccc2oc(-c3ccc(Cl)cc3)nc2c1)[C@@H]1CCCN1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.60
▸ KDM4E B2RXH2 5/20 0.60
▸ HPGD P15428 5/20 0.60
▸ SMN1; SMN2 Q16637 4/20 0.60
▸ ALDH1A1 P00352 4/20 0.60
▸ NPC1 O15118 3/20 0.60
▸ RAB9A P51151 3/20 0.60
▸ CASP3 P42574 3/20 0.59
▸ SENP7 Q9BQF6 3/20 0.59
▸ SENP8 Q96LD8 1/20 0.59
▸ SENP6 Q9GZR1 1/20 0.59
▸ RXFP1 Q9HBX9 2/20 0.54
▸ POLB P06746 2/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ KDR P35968 4/20 0.53
▸ HSD17B10 Q99714 3/20 0.52
▸ USP2 O75604 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ AHR P35869 1/20 0.52
▸ PPARG P37231 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
SCHEMBL2245336 1.00 MAPT (0.60) MAPTKDM4EHPGDSMN1; SMN2ALDH1A1
SCHEMBL10222766 0.94 ALDH1A1 (0.58) MAPTKDM4EHPGDSMN1; SMN2ALDH1A1
SCHEMBL2248739 0.84 MAPT (0.65) MAPTKDM4EHPGDSMN1; SMN2ALDH1A1
SCHEMBL2245386 0.84 MAPT (0.65) MAPTKDM4EHPGDSMN1; SMN2ALDH1A1
SCHEMBL2243986 0.84 CASP3 (0.70) MAPTKDM4EHPGDSMN1; SMN2ALDH1A1
SCHEMBL10223745 0.78 SCN9A (0.53) MAPTKDM4EHPGDSMN1; SMN2ALDH1A1
SCHEMBL85092 0.78 RAB9A (0.56) SMN1; SMN2ALDH1A1NPC1RAB9APOLB
Hydrochloric Acid SCHEMBL76439 0.76 SCN3A (0.57) SMN1; SMN2ALDH1A1NPC1RAB9APOLB
Hydrochloric Acid SCHEMBL76440 0.76 SCN3A (0.57) SMN1; SMN2ALDH1A1NPC1RAB9APOLB
SCHEMBL2243746 0.76 MAPT (0.98) MAPTKDM4ESMN1; SMN2ALDH1A1NPC1

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 3113/4885KDM4E 3311/4885HPGD 266/4885
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY PYGM, CPT1B, GYS1 MAPT 3113/4885KDM4E 3311/4885HPGD 266/4885
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 MAPT 4858/4885KDM4E 2080/4885HPGD 2753/4885
US-20090075938-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 MAPT 4858/4885KDM4E 2080/4885HPGD 2753/4885

“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.

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