SCHEMBL11030172

SCHEMBL11030172

CCCCCCC=NC(=O)SCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.40
TERT O14746 3/20 0.39
PTPN1 P18031 3/20 0.39
PPARG P37231 3/20 0.39
PPARD Q03181 3/20 0.39
PPARA Q07869 3/20 0.39
CYP1A2 P05177 2/20 0.39
MAPT P10636 2/20 0.39
CYP2C19 P33261 2/20 0.39
BLM P54132 2/20 0.39
HSD17B10 Q99714 2/20 0.39
FABP4 P15090 2/20 0.39
FAAH O00519 2/20 0.39
KMT2A Q03164 2/20 0.39
TOP1 P11387 2/20 0.39
GMNN O75496 1/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL27336929 0.98 EP300 (0.37) EP300TERTPTPN1PPARGPPARD
SCHEMBL28238771 0.76 TOP1 (0.52) EP300TERTPTPN1PPARGPPARD
SCHEMBL28474044 0.75 FAAH (0.52) EP300TERTCYP1A2MAPTCYP2C19
SCHEMBL28485780 0.75 FAAH (0.52) EP300TERTCYP1A2MAPTCYP2C19
SCHEMBL11781984 0.75 EP300 (0.44) EP300TERTPTPN1PPARGPPARD
SCHEMBL6358916 0.74 TOP1 (0.48) EP300TERTPTPN1PPARGPPARD
SCHEMBL7562509 0.74 TOP1 (0.48) EP300TERTPTPN1PPARGPPARD
SCHEMBL5136587 0.73 TERT (0.50) TERTPTPN1PPARGPPARDPPARA
SCHEMBL27442584 0.72 FAAH (0.48) EP300TERTPTPN1PPARGPPARD
SCHEMBL28403140 0.72 TSHR (0.45) EP300TERTPTPN1PPARGPPARD

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
EP-0068295-B1 A NEW HERBICIDAL COMPOSITION, PROCESSES FOR ITS PRODUCTION AND ITS USE A. Nattermann & Cie. GmbH (DE) 1985-08-28 EP claimed