Heptanoate

Heptanoate

SCHEMBL28136454

CCCCCCC(=O)O.O=C(O)C1CCC2OC2C1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.50
PPARG P37231 7/20 0.50
PPARD Q03181 7/20 0.50
PPARA Q07869 7/20 0.50
HDAC11 Q96DB2 5/20 0.50
TSHR P16473 4/20 0.50
PTPN1 P18031 3/20 0.50
ALDH1A1 P00352 2/20 0.50
TLR2 O60603 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
FABP4 P15090 2/20 0.50
KMT2A Q03164 2/20 0.50
SLC22A6 Q4U2R8 1/20 0.50
SLC22A8 Q8TCC7 1/20 0.50
MEN1 O00255 1/20 0.50
ESR1 P03372 1/20 0.50
ALOX15 P16050 1/20 0.50
PDE4A P27815 1/20 0.50
PDE3A Q14432 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
Adipic Acid SCHEMBL28874710 0.91 LMNA (0.41) TSHRALDH1A1TDP1KMT2ASLC22A6
Hexane SCHEMBL28833639 0.85 PPM1B (0.38) TSHRPTPN1TBXA2R
SCHEMBL5274882 0.81 ABL1 (0.38) TSHRALDH1A1
SCHEMBL2184024 0.79 TFPI2 (0.52) TSHRPTPN1
SCHEMBL4098788 0.79 TFPI2 (0.52) TSHRPTPN1
SCHEMBL124941 0.79 TFPI2 (0.52) TSHRPTPN1
SCHEMBL4109815 0.79 TFPI2 (0.52) TSHRPTPN1
SCHEMBL4948347 0.79 TFPI2 (0.52) TSHRPTPN1
SCHEMBL7263479 0.79 TFPI2 (0.52) TSHRPTPN1
SCHEMBL2726787 0.79 TFPI2 (0.52) TSHRPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106432725-B Polyamide-imide resin and its manufacture method, thermosetting resin composition and its hardening thing 爱沃特株式会社 2018-03-27 CN disclosed
CN-106432725-A Polyamide-imide resin and manufacturing method thereof, thermosetting resin composition and cured product thereof 爱沃特株式会社 2017-02-22 CN disclosed