SCHEMBL7079388

SCHEMBL7079388

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
SOAT1 P35610 2/20 0.39
MEN1 O00255 2/20 0.39
CYP1A2 P05177 2/20 0.39
KMT2A Q03164 2/20 0.39
FAAH O00519 1/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
KDM4E B2RXH2 2/20 0.36
CNR1 P21554 1/20 0.33
FDPS P14324 2/20 0.32
ALDH1A1 P00352 2/20 0.32
THRB P10828 1/20 0.32
ARG1 P05089 1/20 0.32
ARG2 P78540 1/20 0.32
SMPD1 P17405 2/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31

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
SCHEMBL4149223 0.98 SOAT1 (0.42) CYP4F2CYP4A11SOAT1MEN1CYP1A2
SCHEMBL989014 0.98 SOAT1 (0.42) CYP4F2CYP4A11SOAT1MEN1CYP1A2
SCHEMBL8496388 0.98 SOAT1 (0.42) CYP4F2CYP4A11SOAT1MEN1CYP1A2
Hydrochloric Acid SCHEMBL2413365 0.96 SOAT1 (0.41) CYP4F2CYP4A11SOAT1MEN1CYP1A2
Hydrochloric Acid SCHEMBL2418570 0.96 SOAT1 (0.41) CYP4F2CYP4A11SOAT1MEN1CYP1A2
SCHEMBL4147412 0.93 CYP4F2 (0.37) CYP4F2CYP4A11SOAT1MEN1CYP1A2
SCHEMBL2294520 0.86 MEN1 (0.34) CYP4F2CYP4A11SOAT1MEN1CYP1A2
SCHEMBL7079387 0.85 MEN1 (0.39) CYP4F2CYP4A11SOAT1MEN1CYP1A2
SCHEMBL8496383 0.83 MEN1 (0.41) CYP4F2CYP4A11SOAT1MEN1CYP1A2
SCHEMBL11782562 0.83 SOAT1 (0.55) SOAT1MEN1CYP1A2KMT2AFAAH

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