SCHEMBL2654732

SCHEMBL2654732

O=Cc1cccc(OCC(=O)NCC(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.51
MAOB P27338 6/20 0.51
KMT2A Q03164 3/20 0.48
MAPT P10636 2/20 0.48
MEN1 O00255 1/20 0.48
SRC P12931 1/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.46
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
POLB P06746 2/20 0.44
PKM P14618 1/20 0.44

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
SCHEMBL353914 0.87 MAOA (0.61) MAOAMAOBSRCLMNA
SCHEMBL29952545 0.84 ALDH1A1 (0.60) MAOAMAOBSRCHPGDKDM4E
SCHEMBL29951626 0.84 KMT2A (0.69) MAOAMAOBKMT2AMEN1HPGD
SCHEMBL2654762 0.83 MAOA (0.43) MAOAMAOBKMT2AMAPTMEN1
SCHEMBL2559020 0.82 ALDH1A1 (0.57) MAOAMAOBKMT2AMAPTMEN1
SCHEMBL2556267 0.82 SMN1; SMN2 (0.61) MAOAMAOBKMT2AMEN1SRC
SCHEMBL13932642 0.82 UNG (0.54) MAOAMAOBKMT2AMEN1ALDH1A1
SCHEMBL15329632 0.81 ALDH1A1 (0.58) MAOAMAOBKMT2ASRCALDH1A1
SCHEMBL6541246 0.81 ALDH1A1 (0.60) MAOAMAOBKMT2AMEN1SRC
SCHEMBL2560052 0.81 MAOA (0.46) MAOAMAOBKMT2AMEN1SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1585517-A1 USE OF SUBSTITUTED 2-PHENYLBENZIMIDAZOLES AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2005-10-19 EP disclosed
US-20050014810-A1 Use of substituted 2 phenylbenzimidazoles as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-01-20 US disclosed
WO-2004062663-A1 USE OF SUBSTITUTED 2-PHENYLBENZIMIDAZOLES AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2004-07-29 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 (1 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-20050014810-A1 Use of substituted 2 phenylbenzimidazoles as medicaments GLP1R, GIPR, GCGR MAOA 2189/4885MAOB 1115/4885KMT2A 2473/4885

“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.