SCHEMBL15527706

SCHEMBL15527706

CC(=CP(C1CCCCC1)C1CCCCC1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.41
RAB9A P51151 2/20 0.36
LMNA P02545 2/20 0.36
ALOX12 P18054 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
MCL1 Q07820 1/20 0.33
NPC1 O15118 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
SCN1A P35498 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
POLB P06746 1/20 0.33
ELANE P08246 1/20 0.33
KMO O15229 1/20 0.33

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
SCHEMBL15364811 0.82 CHRNB2 (0.39) RAB9ASMN1; SMN2ALDH1A1GAAMCL1
SCHEMBL15364446 0.80 MTNR1A (0.37) RAB9ALMNAALDH1A1GAAMCL1
Acetophenone SCHEMBL22534399 0.74 ALDH1A1 (0.40) RAB9ALMNASMN1; SMN2ALDH1A1GAA
Acetophenone SCHEMBL28200922 0.70 SMN1; SMN2 (0.39) RAB9ALMNASMN1; SMN2ALDH1A1GAA
SCHEMBL377393 0.70 RAB9A (0.37) RAB9ALMNAALOX12SMN1; SMN2ALDH1A1
SCHEMBL23244057 0.69 KDM1A (0.41) KDM1ARAB9ALMNAALOX12SMN1; SMN2
SCHEMBL21596559 0.69 KDM1A (0.41) KDM1ARAB9ALMNAALOX12SMN1; SMN2
SCHEMBL15527711 0.69 HPGD (0.41) KDM1ASMN1; SMN2ALDH1A1GAA
SCHEMBL15527450 0.69 KDM1A (0.42) KDM1AALDH1A1
SCHEMBL15527470 0.68 KDM1A (0.39) KDM1ALMNASMN1; SMN2

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
EP-2844678-A1 POLYDIENES AND DIENE COPOLYMERS HAVING ORGANOPHOSPHINE FUNCTIONALITY Bridgestone Corporation (JP) 2015-03-11 EP disclosed
WO-2013166124-A1 POLYDIENES AND DIENE COPOLYMERS HAVING ORGANOPHOSPHINE FUNCTIONALITY BRIDGESTONE CORPORATION (JP) 2013-11-07 WO disclosed