SCHEMBL9800734

SCHEMBL9800734

CCCCCCCCCCCCCCCCCC[CH]NC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.50
TERT O14746 3/20 0.48
PTPN1 P18031 3/20 0.48
PPARG P37231 3/20 0.48
PPARD Q03181 3/20 0.48
PPARA Q07869 3/20 0.48
TOP1 P11387 3/20 0.48
MAPT P10636 2/20 0.48
BLM P54132 2/20 0.48
HSD17B10 Q99714 2/20 0.48
FABP4 P15090 2/20 0.48
DUSP3 P51452 2/20 0.48
GMNN O75496 1/20 0.48
USP2 O75604 1/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
POLB P06746 1/20 0.48
CYP2C9 P11712 1/20 0.48
ALOX15 P16050 1/20 0.48
APEX1 P27695 1/20 0.48

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
SCHEMBL10893304 0.83 EP300 (0.45) EP300TERTPTPN1PPARGPPARD
SCHEMBL10531391 0.83 EP300 (0.45) EP300TERTPTPN1PPARGPPARD
SCHEMBL10886696 0.83 EP300 (0.45) EP300TERTPTPN1PPARGPPARD
SCHEMBL7463705 0.81
SCHEMBL7994523 0.81 FAAH (0.52) EP300TERTPTPN1PPARGPPARD
SCHEMBL19921858 0.81 FAAH (0.52) EP300TERTPTPN1PPARGPPARD
SCHEMBL27797544 0.80 FAAH (0.47) EP300MAPTBLMHSD17B10DUSP3
SCHEMBL1556426 0.80 EP300 (0.42) EP300TERTPTPN1PPARGPPARD
SCHEMBL10895511 0.79 HSP90AA1 (0.55) TERTPTPN1PPARGPPARDPPARA
SCHEMBL10531381 0.79 HSP90AA1 (0.55) TERTPTPN1PPARGPPARDPPARA

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-5051196-A Fabric softener of a quaternary ammonium salts and crosslinked polysiloxanes COLGATE-PALMOLIVE CO. (US) 1991-09-24 US disclosed