SCHEMBL11036066

SCHEMBL11036066

O=CCCCCCCCCCCCCC(=O)Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.52
ALDH1A1 P00352 2/20 0.52
TP53 P04637 1/20 0.44
HIF1A Q16665 1/20 0.43
FAAH O00519 4/20 0.39
TRPV1 Q8NER1 1/20 0.39
MAPT P10636 3/20 0.38
ABCC4 O15439 1/20 0.38
TERT O14746 3/20 0.34
BLM P54132 2/20 0.34
HSD17B10 Q99714 2/20 0.34
FABP4 P15090 2/20 0.34
F7 P08709 2/20 0.34
F3 P13726 2/20 0.34
PTPN1 P18031 2/20 0.34
PPARG P37231 2/20 0.34
PPARD Q03181 2/20 0.34
PPARA Q07869 2/20 0.34
GMNN O75496 1/20 0.34
USP2 O75604 1/20 0.34

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
SCHEMBL4760060 1.00 TSHR (0.52) TSHRALDH1A1TP53HIF1AFAAH
SCHEMBL4759135 1.00 TSHR (0.52) TSHRALDH1A1TP53HIF1AFAAH
SCHEMBL1278647 1.00 TSHR (0.52) TSHRALDH1A1TP53HIF1AFAAH
SCHEMBL4757903 1.00 TSHR (0.52) TSHRALDH1A1TP53HIF1AFAAH
SCHEMBL18403799 1.00 TSHR (0.52) TSHRALDH1A1TP53HIF1AFAAH
SCHEMBL1278497 1.00 TSHR (0.52) TSHRALDH1A1TP53HIF1AFAAH
SCHEMBL1278750 1.00 TSHR (0.52) TSHRALDH1A1TP53HIF1AFAAH
SCHEMBL11658791 1.00 TSHR (0.52) TSHRALDH1A1TP53HIF1AFAAH
SCHEMBL8746943 1.00 TSHR (0.52) TSHRALDH1A1TP53HIF1AFAAH
SCHEMBL735082 0.97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-59104339-A None JP disclosed
JP-59199650-A None JP disclosed
JP-S59199650-A PRODUCTION OF LONG-CHAIN DIKETONE NIPPON MINING CO LTD 1984-11-12 JP disclosed
JP-S59104339-A PREPARATION OF 2,15-HEXADECANEDIONE NIPPON MINING CO LTD 1984-06-16 JP disclosed
US-4087481-A INJECTION MOLDING MATERIALS THE UPJOHN COMPANY (US) 1978-05-02 US disclosed
US-4072665-A Polyamide from arylene diamine, isophthalic acid and alkylene dicarboxylic acid THE UPJOHN COMPANY (US) 1978-02-07 US disclosed