SCHEMBL7200510

SCHEMBL7200510

CCCCCCCCCCCCCCCCCCN(C(N)=O)c1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
PAX8 Q06710 2/20 0.47
JAK2 O60674 1/20 0.47
HSD17B3 P37058 6/20 0.43
PTGES O14684 2/20 0.41
ALOX5 P09917 2/20 0.41
ESR1 P03372 3/20 0.40
ADRA2A P08913 2/20 0.40
ADORA3 P0DMS8 2/20 0.40
TACR2 P21452 2/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
ALDH1A1 P00352 2/20 0.40
TP53 P04637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
SHBG P04278 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
SCHEMBL1831021 0.95 NPC1 (0.50) LTB4R2NPC1RAB9APAX8JAK2
SCHEMBL7262762 0.95 NPC1 (0.50) LTB4R2NPC1RAB9APAX8JAK2
SCHEMBL8756523 0.95 NPC1 (0.50) LTB4R2NPC1RAB9APAX8JAK2
SCHEMBL7264331 0.95 NPC1 (0.50) LTB4R2NPC1RAB9APAX8JAK2
SCHEMBL7268930 0.95 NPC1 (0.50) LTB4R2NPC1RAB9APAX8JAK2
SCHEMBL7264118 0.95 NPC1 (0.50) LTB4R2NPC1RAB9APAX8JAK2
SCHEMBL7269065 0.95 NPC1 (0.50) LTB4R2NPC1RAB9APAX8JAK2
SCHEMBL7264200 0.95 NPC1 (0.50) LTB4R2NPC1RAB9APAX8JAK2
SCHEMBL7269051 0.95 NPC1 (0.50) LTB4R2NPC1RAB9APAX8JAK2
SCHEMBL7270465 0.95 NPC1 (0.50) LTB4R2NPC1RAB9APAX8JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6596669-B1 Comprising a support and two reversible heat-sensitive recording layers having different colors formed on the same side of the support, comprising colorless electron-donative dye precursor and an electron-accepting compound MITSUBISHI PAPER MILLS LIMITED (JP) 2003-07-22 US disclosed