SCHEMBL9124129

SCHEMBL9124129

CCCCCCN(CCC(=O)O)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ICMT O60725 2/20 0.55
ALB P02768 2/20 0.55
NPC1 O15118 1/20 0.54
JAK2 O60674 1/20 0.54
RAB9A P51151 1/20 0.54
PAX8 Q06710 1/20 0.54
ATG4B Q9Y4P1 1/20 0.50
CNR2 P34972 2/20 0.48
TP53 P04637 1/20 0.46
TACR1 P25103 1/20 0.46
PPARG P37231 6/20 0.46
PPARD Q03181 6/20 0.46
PPARA Q07869 6/20 0.46
HDAC11 Q96DB2 5/20 0.46
TSHR P16473 4/20 0.46
GPR84 Q9NQS5 4/20 0.46
ALDH1A1 P00352 2/20 0.46
TLR2 O60603 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
FABP4 P15090 2/20 0.46

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
SCHEMBL9125373 0.94 NPC1 (0.54) ICMTALBNPC1JAK2RAB9A
SCHEMBL9124134 0.94 NPC1 (0.54) ICMTALBNPC1JAK2RAB9A
SCHEMBL9122844 0.94 GPR84 (0.55) ICMTALBNPC1JAK2RAB9A
SCHEMBL11851063 0.93 ATG4B (0.55) ICMTALBNPC1JAK2RAB9A
SCHEMBL11495859 0.92 NPC1 (0.51) ICMTALBNPC1JAK2RAB9A
SCHEMBL25329827 0.90 GPR84 (0.50) ICMTALBNPC1JAK2RAB9A
SCHEMBL9125194 0.87 NPC1 (0.47) NPC1JAK2RAB9APAX8TP53
SCHEMBL9125852 0.86 TP53 (0.51) NPC1RAB9AATG4BCNR2TP53
SCHEMBL4541804 0.86 NPC1 (0.50) ICMTALBNPC1JAK2RAB9A
SCHEMBL25229294 0.86 NPC1 (0.53) ICMTALBNPC1JAK2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2828339-B1 CARBOXYLATE DYES MILLIKEN & CO (US) 2018-10-31 EP disclosed
US-20160075977-A1 LAUNDRY CARE COMPOSITIONS CONTAINING DYES PROCTER & GAMBLE (US) 2016-03-17 US disclosed
US-9187717-B2 Carboxylate dyes MILLIKEN & COMPANY (US) 2015-11-17 US disclosed
US-20150099869-A1 Carboxylate Dyes MILLIKEN & COMPANY 2015-04-09 US disclosed
EP-2828339-A1 CARBOXYLATE DYES Milliken & Company (US) 2015-01-28 EP disclosed
EP-2828340-A1 LAUNDRY CARE COMPOSITIONS CONTAINING DYES The Procter & Gamble Company (US) 2015-01-28 EP disclosed
US-20150000048-A1 LAUNDRY CARE COMPOSITIONS CONTAINING DYES THE PROCTER & GAMBLE COMPANY 2015-01-01 US disclosed
WO-2013142495-A1 CARBOXYLATE DYES MILLIKEN & COMPANY (US) 2013-09-26 WO disclosed
WO-2013142486-A1 LAUNDRY CARE COMPOSITIONS CONTAINING DYES THE PROCTER & GAMBLE COMPANY (US) 2013-09-26 WO disclosed
US-5397781-A Pyrimidine derivatives MOCHIDA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-03-14 US disclosed
EP-0561175-A1 Pyrimidine derivatives and pharmaceutical compostions containing them MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1993-09-22 EP disclosed