SCHEMBL11260061

SCHEMBL11260061

CCCCCCCCC=CCCCCCCCC(=O)NC(C)(C)C

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.71
TERT O14746 3/20 0.58
PTPN1 P18031 3/20 0.58
PPARG P37231 3/20 0.58
PPARD Q03181 3/20 0.58
PPARA Q07869 3/20 0.58
KMT2A Q03164 3/20 0.58
CYP1A2 P05177 2/20 0.58
MAPT P10636 2/20 0.58
CYP2C19 P33261 2/20 0.58
BLM P54132 2/20 0.58
HSD17B10 Q99714 2/20 0.58
FABP4 P15090 2/20 0.58
FAAH O00519 2/20 0.58
MEN1 O00255 2/20 0.58
GMNN O75496 1/20 0.58
USP2 O75604 1/20 0.58
LMNA P02545 1/20 0.58
POLB P06746 1/20 0.58
CYP2C9 P11712 1/20 0.58

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
SCHEMBL11260057 1.00 HRH3 (0.71) HRH3TERTPTPN1PPARGPPARD
Bromide SCHEMBL2169637 0.98 HRH3 (0.69) HRH3TERTPTPN1PPARGPPARD
SCHEMBL22461508 0.95 HRH3 (0.66) HRH3PPARGPPARDPPARAKMT2A
SCHEMBL28340381 0.91 HRH3 (0.59) HRH3TERTPTPN1PPARGPPARD
SCHEMBL23027751 0.90 CNR1 (0.65) PPARGPPARDPPARAKMT2AMAPT
SCHEMBL12057493 0.89 HSP90AA1 (0.59) HRH3PTPN1PPARGPPARDPPARA
SCHEMBL24507360 0.89 HSP90AA1 (0.59) HRH3PTPN1PPARGPPARDPPARA
SCHEMBL13701707 0.89 HSP90AA1 (0.59) HRH3PTPN1PPARGPPARDPPARA
SCHEMBL23378025 0.89 HSP90AA1 (0.59) HRH3PTPN1PPARGPPARDPPARA
SCHEMBL12920382 0.89 HSP90AA1 (0.59) HRH3PTPN1PPARGPPARDPPARA

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
US-4313888-A NONIONIC SURFACTANTS USED IN COSMETICS KANEBO LTD. (JP) 1982-02-02 US disclosed