SCHEMBL16706151

SCHEMBL16706151

CCCCCCCCCOCCCCCCCCCOC(=O)c1ccc(C(=O)OC)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.68
RAB9A P51151 2/20 0.68
ALDH1A1 P00352 2/20 0.68
MAPT P10636 1/20 0.68
LMNA P02545 3/20 0.59
TSHR P16473 3/20 0.59
CYP1A2 P05177 2/20 0.59
CYP2C19 P33261 2/20 0.59
ESR1 P03372 2/20 0.59
CYP2D6 P10635 1/20 0.59
MAPK1 P28482 1/20 0.59
NR1H2 P55055 1/20 0.59
RNASEL Q05823 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
CASP1 P29466 1/20 0.58
STS P08842 6/20 0.58
CYP3A4 P08684 2/20 0.58
CYP2C9 P11712 1/20 0.58
PDE4D Q08499 1/20 0.58
HPGD P15428 1/20 0.56

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
SCHEMBL1937111 0.95 NPC1 (0.73) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10332514 0.95 NPC1 (0.73) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL12918679 0.95 NPC1 (0.73) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL20175327 0.95 NPC1 (0.73) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL13763479 0.95 NPC1 (0.73) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL13227995 0.94 NPC1 (0.71) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL13412591 0.94 NPC1 (0.71) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL17565215 0.92 NPC1 (0.69) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL19649668 0.90 LMNA (0.72) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL24654255 0.89 ALDH1A1 (0.69) NPC1RAB9AALDH1A1MAPTLMNA

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
US-9110391-B2 Super low melt toner having crystalline diesters with an aromatic core XEROX CORPORATION (US) 2015-08-18 US disclosed
US-20150132694-A1 SUPER LOW MELT TONER HAVING CRYSTALLINE DIESTERS WITH AN AROMATIC CORE XEROX CORPORATION (US) 2015-05-14 US disclosed
US-20150132693-A1 SUPER LOW MELT TONER HAVING SMALL MOLECULE PLASTICIZERS XEROX CORPORATION (US) 2015-05-14 US disclosed