SCHEMBL7079387

SCHEMBL7079387

CCC(CC)(CCCCC(N)=O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 3/20 0.39
CYP1A2 P05177 2/20 0.39
THRB P10828 1/20 0.39
CYP4F2 P78329 2/20 0.39
CYP4A11 Q02928 2/20 0.39
SOAT1 P35610 2/20 0.38
FAAH O00519 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
ARG1 P05089 2/20 0.38
ARG2 P78540 2/20 0.38
KDM4E B2RXH2 2/20 0.35
AKR1B1 P15121 1/20 0.33
CNR1 P21554 1/20 0.32
PPARG P37231 5/20 0.32
PPARD Q03181 5/20 0.32
PPARA Q07869 5/20 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
SCHEMBL8496383 0.98 MEN1 (0.41) MEN1KMT2AALDH1A1CYP1A2THRB
SCHEMBL11592331 0.94 KMT2A (0.41) MEN1KMT2AALDH1A1CYP1A2THRB
SCHEMBL9181629 0.87 CYP4F2 (0.47) MEN1KMT2AALDH1A1CYP1A2THRB
SCHEMBL7079388 0.85 CYP4F2 (0.40) MEN1KMT2AALDH1A1CYP1A2THRB
SCHEMBL1483105 0.85 AKR1B1 (0.50) MEN1KMT2AALDH1A1CYP1A2THRB
SCHEMBL9183579 0.84 CYP4F2 (0.45) MEN1KMT2AALDH1A1CYP1A2THRB
SCHEMBL14809032 0.83 GPR84 (0.52) MEN1KMT2AALDH1A1CYP1A2THRB
SCHEMBL8056020 0.83 GPR84 (0.52) MEN1KMT2AALDH1A1CYP1A2THRB
SCHEMBL14809846 0.83 GPR84 (0.52) MEN1KMT2AALDH1A1CYP1A2THRB
SCHEMBL14809975 0.83 GPR84 (0.52) MEN1KMT2AALDH1A1CYP1A2THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030005487-A1 Isolation and characterization of heat shock protein ELTHON THOMAS E (US) 2003-01-02 US disclosed
US-20020104130-A1 Isolation and characterization of heat shock protein ELTHON THOMAS E (US) 2002-08-01 US disclosed
US-6268548-B1 VECTOR INCLUDING DEFINED NUCLEOTIDE SEQUENCE; FOR TRANSGENIC PLANTS WITH HEAT RESISTANCE BOARD OF REGENTS OF UNIVERSITY OF NEBRASKA 2001-07-31 US disclosed
WO-2000047714-A2 ISOLATION AND CHARACTERIZATION OF HEAT SHOCK PROTEIN BOARD OF REGENTS OF UNIVERSITY OF NEBRASKA (US) 2000-08-17 WO disclosed