SCHEMBL14868147

SCHEMBL14868147

CCC(C)C(C(=O)OCCCCCCCCCCOC(=O)C(C(C)CC)N1C(=O)C=CC1=O)N1C(=O)C=CC1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.37
CHRM4 P08173 2/20 0.37
CHRM1 P11229 2/20 0.37
CHRM3 P20309 2/20 0.37
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
BLM P54132 1/20 0.36
WRN Q14191 1/20 0.36
HIF1A Q16665 1/20 0.36
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
TSHR P16473 1/20 0.33
LMNA P02545 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NAAA Q02083 1/20 0.32

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
SCHEMBL15394471 1.00 CHRM2 (0.37) CHRM2CHRM4CHRM1CHRM3ALDH1A1
SCHEMBL21917311 1.00 CHRM2 (0.37) CHRM2CHRM4CHRM1CHRM3ALDH1A1
SCHEMBL14868137 0.86 ALDH1A1 (0.35) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL15393993 0.86 ALDH1A1 (0.35) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL14868167 0.84 ALDH1A1 (0.36) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL21917545 0.83 ALDH1A1 (0.39) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL15393983 0.80 ALDH1A1 (0.33) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL14868135 0.79 ALDH1A1 (0.37) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL14868136 0.79 ALDH1A1 (0.37) ALDH1A1HPGDCYP1A2CYP2C19BLM
SCHEMBL14868142 0.79 ALDH1A1 (0.37) ALDH1A1HPGDCYP1A2CYP2C19BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9416289-B2 Active-energy-ray-curable inkjet ink composition, active-energy-ray-curable inkjet ink, and inkjet recording method Konica Minolta, Inc. (JP) 2016-08-16 US disclosed
US-9416289-B2 Active-energy-ray-curable inkjet ink composition, active-energy-ray-curable inkjet ink, and inkjet recording method Konica Minolta, Inc. (JP) 2016-08-16 US disclosed
US-9175180-B2 Inkjet ink and inkjet image formation method using same Konica Minolta, Inc. (JP) 2015-11-03 US disclosed
US-20140130709-A1 PHOTOCURABLE INK JET INK KONICA MINOLTA , INC. (JP) 2014-05-15 US disclosed
US-20140130709-A1 PHOTOCURABLE INK JET INK KONICA MINOLTA , INC. (JP) 2014-05-15 US disclosed
EP-2722372-A1 PHOTOCURABLE INK JET INK Konica Minolta, Inc. (JP) 2014-04-23 EP disclosed
US-20130307913-A1 ACTIVE-ENERGY-RAY-CURABLE INKJET INK COMPOSITION, ACTIVE-ENERGY-RAY-CURABLE INKJET INK, AND INKJET RECORDING METHOD Konica Minolta, Inc. (JP) 2013-11-21 US disclosed
US-20130095236-A1 INKJET INK AND INKJET IMAGE FORMATION METHOD USING SAME KONICA MINOLTA HOLDINGS, INC. (JP) 2013-04-18 US disclosed