SCHEMBL28876841

SCHEMBL28876841

CCCCCCCC/C=C\CCCCCCCC(=O)[N+](C)(C)CC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 6/20 0.61
TERT O14746 3/20 0.59
PTPN1 P18031 3/20 0.59
PPARG P37231 3/20 0.59
PPARD Q03181 3/20 0.59
PPARA Q07869 3/20 0.59
CYP1A2 P05177 2/20 0.59
MAPT P10636 2/20 0.59
CYP2C19 P33261 2/20 0.59
BLM P54132 2/20 0.59
HSD17B10 Q99714 2/20 0.59
FABP4 P15090 2/20 0.59
FAAH O00519 2/20 0.59
KMT2A Q03164 2/20 0.59
F7 P08709 2/20 0.59
F3 P13726 2/20 0.59
GMNN O75496 1/20 0.59
USP2 O75604 1/20 0.59
LMNA P02545 1/20 0.59
POLB P06746 1/20 0.59

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
Bromide SCHEMBL27788998 0.98 FABP3 (0.59) FABP3TERTPTPN1PPARGPPARD
Bromide SCHEMBL2810645 0.98 FABP3 (0.59) FABP3TERTPTPN1PPARGPPARD
Sulfuric Acid SCHEMBL28151609 0.94 FABP3 (0.54) FABP3TERTPTPN1PPARGPPARD
SCHEMBL17077912 0.89 CES2 (0.52) FABP3PTPN1PPARGPPARDPPARA
Hydrochloric Acid SCHEMBL3148020 0.87 CES2 (0.50) FABP3PTPN1PPARGPPARDPPARA
Hydrochloric Acid SCHEMBL28331063 0.87 CES2 (0.50) FABP3PTPN1PPARGPPARDPPARA
Iodide SCHEMBL10937214 0.86 FABP3 (0.57) FABP3TERTPTPN1PPARGPPARD
Hydrochloric Acid SCHEMBL4954701 0.86 FABP3 (0.57) FABP3TERTPTPN1PPARGPPARD
Bromide SCHEMBL8946622 0.86 FABP3 (0.57) FABP3TERTPTPN1PPARGPPARD
SCHEMBL28610210 0.86 FABP3 (0.61) FABP3TERTPTPN1PPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110291245-A Acrylic fiber treating agent and use thereof 松本油脂制药株式会社 2019-09-27 CN disclosed