SCHEMBL3919664

SCHEMBL3919664

CCC(=O)NCCCCc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.71
HPGD P15428 4/20 0.69
KMT2A Q03164 2/20 0.69
ALDH1A1 P00352 1/20 0.69
L3MBTL1 Q9Y468 1/20 0.67
LMNA P02545 1/20 0.67
TSHR P16473 1/20 0.67
GAA P10253 1/20 0.65
RECQL P46063 1/20 0.59
MTNR1A P48039 1/20 0.59
MTNR1B P49286 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
MEN1 O00255 1/20 0.59

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
SCHEMBL31035861 0.98 TRPV1 (0.73) TRPV1HPGDKMT2AALDH1A1L3MBTL1
SCHEMBL31035980 0.98 TRPV1 (0.73) TRPV1HPGDKMT2AALDH1A1L3MBTL1
SCHEMBL31036003 0.98 TRPV1 (0.73) TRPV1HPGDKMT2AALDH1A1L3MBTL1
SCHEMBL7598872 0.95 L3MBTL1 (0.74) TRPV1HPGDKMT2AALDH1A1L3MBTL1
SCHEMBL25139566 0.89 L3MBTL1 (0.66) TRPV1HPGDKMT2AALDH1A1L3MBTL1
Benzene SCHEMBL29176463 0.87 MTNR1A (0.73) HPGDALDH1A1L3MBTL1MTNR1AMTNR1B
SCHEMBL154367 0.87 MTNR1A (0.73) HPGDALDH1A1L3MBTL1MTNR1AMTNR1B
SCHEMBL15598268 0.87 HPGD (0.77) TRPV1HPGDKMT2AALDH1A1L3MBTL1
SCHEMBL10106175 0.85 L3MBTL1 (0.61) TRPV1HPGDKMT2AL3MBTL1GAA
SCHEMBL15550290 0.85 HDAC3 (0.72) HPGDL3MBTL1LMNATSHRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2038267-A2 THIADIAZOLIDINONE INHIBITORS OF PTPASE Novartis AG (CH) 2009-03-25 EP claimed
WO-2007115058-A2 THIADIAZOLIDINONE INHIBITORS OF PTPASE NOVARTIS AG (CH) 2007-10-11 WO claimed
EP-2038267-A2 THIADIAZOLIDINONE INHIBITORS OF PTPASE Novartis AG (CH) 2009-03-25 EP disclosed
WO-2007115058-A2 THIADIAZOLIDINONE INHIBITORS OF PTPASE NOVARTIS AG (CH) 2007-10-11 WO disclosed
US-7226906-B2 Cyclosporin analogs for the treatment of immunoregulatory disorders and respiratory diseases ARRAY BIOPHARMA, INC. (US) 2007-06-05 US disclosed
EP-1254114-A2 MELANOCORTIN RECEPTOR AGONISTS AND ANTAGONISTS Melacure Therapeutics AB (SE) 2002-11-06 EP disclosed
WO-2001055106-A2 NOVEL MELANOCORTIN RECEPTOR AGONISTS AND ANTAGONISTS MELACURE THERAPEUTICS AB (SE) 2001-08-02 WO disclosed