SCHEMBL2243148

SCHEMBL2243148

O=C(c1ccccc1)c1ccc2nc(-c3ccccc3)[nH]c2c1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 5/20 0.80
KMT2A Q03164 2/20 0.79
MEN1 O00255 1/20 0.79
ESR1 P03372 1/20 0.70
ALDH1A1 P00352 3/20 0.68
HPGD P15428 2/20 0.68
POLB P06746 1/20 0.68
RAB9A P51151 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
ABL1 P00519 1/20 0.68
FABP6 P51161 1/20 0.68
HDAC3 O15379 1/20 0.67
HDAC1 Q13547 1/20 0.67
HDAC8 Q9BY41 1/20 0.67
HDAC6 Q9UBN7 1/20 0.67
PKM P14618 1/20 0.67
PLAU P00749 1/20 0.66
PRSS1 P07477 1/20 0.66
METAP1 P53582 1/20 0.65
MAPT P10636 3/20 0.65

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
SCHEMBL27765862 0.97 CHEK2 (0.78) CHEK2KMT2AMEN1ESR1ALDH1A1
SCHEMBL5675969 0.92 CHEK2 (0.81) CHEK2KMT2AMEN1ESR1ALDH1A1
SCHEMBL19994652 0.91 CHEK2 (0.79) CHEK2KMT2AMEN1ESR1ALDH1A1
SCHEMBL19994499 0.91 CHEK2 (0.79) CHEK2KMT2AMEN1ESR1ALDH1A1
SCHEMBL5679988 0.89 CHEK2 (1.00) CHEK2
SCHEMBL34467256 0.88 CHEK2 (0.64) CHEK2KMT2AMEN1ESR1ALDH1A1
SCHEMBL3178116 0.88 CHEK2 (0.78) CHEK2KMT2AALDH1A1HPGDRAB9A
SCHEMBL19994493 0.86 CHEK2 (0.69) CHEK2KMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL19982678 0.85 CHEK2 (0.74) CHEK2KMT2AMEN1HDAC3HDAC1
SCHEMBL1801062 0.85 CHEK2 (0.63) CHEK2KMT2AMEN1ESR1ALDH1A1

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
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-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 CHEK2 2974/4885KMT2A 3778/4885MEN1 3365/4885
US-20140011782-A1 DRUG COMBINATIONS FOR THE TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY PYGM, CPT1B, GYS1 CHEK2 2974/4885KMT2A 3778/4885MEN1 3365/4885
US-20140018320-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 CHEK2 2874/4885KMT2A 2571/4885MEN1 3847/4885
US-20090075938-A1 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY NR0B1, NR0B2, NR3C1 CHEK2 2874/4885KMT2A 2571/4885MEN1 3847/4885

“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.