SCHEMBL14166160

SCHEMBL14166160

O=C(O)NC(c1ccccc1)c1cccc(OCCCO)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
TAAR1 Q96RJ0 1/20 0.52
ALDH1A1 P00352 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
KDM4E B2RXH2 3/20 0.44
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
TSHR P16473 1/20 0.41
CYSLTR2 Q9NS75 3/20 0.41
CYSLTR1 Q9Y271 3/20 0.41
HRH3 Q9Y5N1 2/20 0.41
NSD2 O96028 1/20 0.40
RECQL P46063 1/20 0.40

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
SCHEMBL14166070 0.84 MEN1 (0.47) KMT2AMEN1TAAR1ALDH1A1SMN1; SMN2
SCHEMBL20373667 0.83 ALOX15 (0.53) KMT2AMEN1TAAR1ALDH1A1SMN1; SMN2
SCHEMBL15775507 0.81 MEN1 (0.50) KMT2AMEN1TAAR1ALDH1A1SMN1; SMN2
SCHEMBL15775508 0.81 MEN1 (0.50) KMT2AMEN1TAAR1ALDH1A1SMN1; SMN2
SCHEMBL14166023 0.80 SIRT2 (0.51) KMT2AMEN1TAAR1ALDH1A1LMNA
SCHEMBL14166237 0.80 MEN1 (0.44) KMT2AMEN1TAAR1ALDH1A1SMN1; SMN2
SCHEMBL17074623 0.80 MEN1 (0.44) KMT2AMEN1TAAR1ALDH1A1SMN1; SMN2
SCHEMBL15777839 0.77 SMPD1 (0.55) KMT2AMEN1ALDH1A1SMN1; SMN2HPGD
SCHEMBL19984429 0.77 CHRM3 (0.62) KMT2AMEN1SMN1; SMN2TSHR
SCHEMBL20373866 0.77 CHRM3 (0.62) KMT2AMEN1SMN1; SMN2TSHR

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-2718280-B1 COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY CHIESI FARMA SPA (IT) 2015-09-16 EP disclosed
EP-2718280-A1 COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY Chiesi Farmaceutici S.p.A. (IT) 2014-04-16 EP disclosed
WO-2012168359-A1 COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY CHIESI FARMACEUTICI S.P.A. (IT) 2012-12-13 WO disclosed