SCHEMBL8723000

SCHEMBL8723000

O=C(O)CCN1C(=O)NC(=O)C1(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1B P35368 3/20 0.46
MAPT P10636 1/20 0.42
FABP3 P05413 1/20 0.40
FABP4 P15090 1/20 0.40
FABP5 Q01469 1/20 0.40
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
APEX1 P27695 1/20 0.39
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MMP3 P08254 1/20 0.38
MMP8 P22894 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
SIRT1 Q96EB6 1/20 0.38

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
SCHEMBL11432815 0.89 FABP4 (0.44) ADRA1BMAPTFABP4FABP5MMP2
SCHEMBL11304673 0.83 ADRA1B (0.48) ADRA1BKDM4EAPEX1LMNAKMT2A
SCHEMBL1571746 0.80 ADRA1B (0.45) ADRA1BMAPTMMP2MMP9ALDH1A1
SCHEMBL11428427 0.76 ADRA1B (0.42) ADRA1BLMNAMMP3MMP8TSHR
SCHEMBL15461426 0.76 ADRA1B (0.47) ADRA1BMAPTMMP2MMP9KDM4E
SCHEMBL11800493 0.75 MEN1 (0.42) ADRA1BMAPTFABP3FABP4FABP5
SCHEMBL14400476 0.75 CYP2C19 (0.48) ADRA1BMAPTMMP2MMP9KDM4E
SCHEMBL11424253 0.73 TDP1 (0.50) MAPTSMN1; SMN2L3MBTL1
SCHEMBL15461431 0.72 OPRL1 (0.41) ADRA1BKDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL11420415 0.71 ADRA1B (0.44) ADRA1BMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5763191-A BINDING MATRIX BOEHRINGER MANNHEIM GMBH (DE) 1998-06-09 US disclosed
EP-0515615-B1 UNIVERSAL BINDING FILM BOEHRINGER MANNHEIM GMBH (DE) 1996-09-04 EP disclosed