SCHEMBL6779534

SCHEMBL6779534

CC(C)(C)OC(=O)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.65
NR4A2 P43354 2/20 0.64
NR4A1 P22736 1/20 0.64
NR4A3 Q92570 1/20 0.64
PARP10 Q53GL7 1/20 0.60
SRD5A2 P31213 1/20 0.59
ADRB2 P07550 1/20 0.58
ADRB1 P08588 1/20 0.58
ADRB3 P13945 1/20 0.58
PLA2G4B P0C869 1/20 0.56
PPARG P37231 1/20 0.56
RXRA P19793 2/20 0.55
RXRB P28702 2/20 0.55
ALDH1A1 P00352 2/20 0.55
HTT P42858 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
EGFR P00533 2/20 0.55
HDAC3 O15379 1/20 0.53
HDAC1 Q13547 1/20 0.53

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
SCHEMBL18259890 0.90 RXRA (0.70) MAOBNR4A2NR4A1NR4A3PARP10
SCHEMBL578461 0.88 MAPT (0.54) MAOBNR4A2NR4A1NR4A3PARP10
SCHEMBL24848155 0.84 KMT2A (0.69) ADRB2ADRB1ADRB3ALDH1A1SMN1; SMN2
SCHEMBL978502 0.83 RAB9A (0.71) MAOBNR4A2NR4A1NR4A3PARP10
SCHEMBL4059146 0.82 NR4A1 (0.74) MAOBNR4A2NR4A1NR4A3PARP10
SCHEMBL864308 0.82 HDAC1 (0.61) MAOBNR4A2NR4A1NR4A3PARP10
SCHEMBL4062398 0.82 MAOB (0.56) MAOBNR4A2NR4A1NR4A3PARP10
SCHEMBL4839180 0.81 MAPT (0.71) ADRB2ADRB1ADRB3HTTSMN1; SMN2
SCHEMBL15189660 0.81 MAOB (0.69) MAOBNR4A2NR4A1NR4A3PARP10
SCHEMBL832428 0.81 HDAC1 (0.56) MAOBNR4A2NR4A1NR4A3PARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212158-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL MYERS SQUIBB CO (US) 2023-07-06 US disclosed
US-20230212158-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL MYERS SQUIBB CO (US) 2023-07-06 US disclosed
US-8389564-B2 Proteasome inhibitors TRIPHASE RESEARCH AND DEVELOPMENT I CORP. (CA) 2013-03-05 US disclosed
US-8389564-B2 Proteasome inhibitors TRIPHASE RESEARCH AND DEVELOPMENT I CORP. (CA) 2013-03-05 US disclosed
US-20120270919-A1 PROTEASOME INHIBITORS NEREUS PHARMACEUTICALS, INC. (US) 2012-10-25 US disclosed
US-20120270919-A1 PROTEASOME INHIBITORS NEREUS PHARMACEUTICALS, INC. (US) 2012-10-25 US disclosed
US-8227503-B2 Proteasome inhibitors NEREUS PHARMACEUTICALS, INC. (US) 2012-07-24 US disclosed
US-8227503-B2 Proteasome inhibitors NEREUS PHARMACEUTICALS, INC. (US) 2012-07-24 US disclosed
US-20110172285-A1 PROTEASOME INHIBITORS NEREUS PHARMACEUTICALS, INC. (US) 2011-07-14 US disclosed
US-20110172285-A1 PROTEASOME INHIBITORS NEREUS PHARMACEUTICALS, INC. (US) 2011-07-14 US disclosed
US-7910616-B2 Proteasome inhibitors NEREUS PHARMACEUTICALS, INC. (US) 2011-03-22 US disclosed
US-7910616-B2 Proteasome inhibitors NEREUS PHARMACEUTICALS, INC. (US) 2011-03-22 US disclosed
US-20090298906-A1 PROTEASOME INHIBITORS NEREUS PHARMACEUTICALS, INC. (US) 2009-12-03 US disclosed
US-20090298906-A1 PROTEASOME INHIBITORS NEREUS PHARMACEUTICALS, INC. (US) 2009-12-03 US disclosed
EP-1183251-B1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA SA (ES) 2004-02-11 EP disclosed
US-6683096-B2 Indolylpiperidine derivatives as antihistaminic and antiallergic agents ALMIRALL PRODESFARMA, S.A. (ES) 2004-01-27 US disclosed
US-20020147344-A1 Indolylpiperidine derivatives as antihistaminic and antiallergic agents ALMIRALL PRODESFARMA, S.A. (ES) 2002-10-10 US disclosed
EP-1183251-A1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS Almirall Prodesfarma, S.A. (ES) 2002-03-06 EP disclosed
WO-2000075130-A1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA, S.A. (ES) 2000-12-14 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 (5 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-20020147344-A1 Indolylpiperidine derivatives as antihistaminic and antiallergic agents HRH2, HRH1, HRH4 MAOB 209/4885NR4A2 2140/4885NR4A1 906/4885
US-20230212158-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 LGALS3, LGALS1, LGALS3BP MAOB 3506/4885NR4A2 4483/4885NR4A1 4381/4885
US-20120270919-A1 PROTEASOME INHIBITORS PSMB1, PSME1, PSME3 MAOB 3837/4885NR4A2 1433/4885NR4A1 1543/4885
US-20090298906-A1 PROTEASOME INHIBITORS PSMB1, PSME1, PSME3 MAOB 3837/4885NR4A2 1433/4885NR4A1 1543/4885
US-20110172285-A1 PROTEASOME INHIBITORS PSMB1, PSME1, PSME3 MAOB 3837/4885NR4A2 1433/4885NR4A1 1543/4885

“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.