SCHEMBL9262181

SCHEMBL9262181

CCCCCCC/C=C(\C)[C]=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.50
TSHR P16473 1/20 0.44
FAAH O00519 4/20 0.40
TRPV1 Q8NER1 1/20 0.40
TERT O14746 3/20 0.39
PTPN1 P18031 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
PPARG P37231 2/20 0.39
KMT2A Q03164 2/20 0.39
PPARD Q03181 2/20 0.39
PPARA Q07869 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

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
SCHEMBL16431472 1.00 EP300 (0.50) EP300TSHRFAAHTRPV1TERT
SCHEMBL17240914 1.00 EP300 (0.50) EP300TSHRFAAHTRPV1TERT
SCHEMBL9262187 1.00 EP300 (0.50) EP300TSHRFAAHTRPV1TERT
SCHEMBL6053800 1.00 EP300 (0.50) EP300TSHRFAAHTRPV1TERT
SCHEMBL6053797 1.00 EP300 (0.50) EP300TSHRFAAHTRPV1TERT
SCHEMBL4130255 0.98 EP300 (0.47) EP300TSHRFAAHTRPV1TERT
SCHEMBL4130257 0.98 EP300 (0.47) EP300TSHRFAAHTRPV1TERT
SCHEMBL4145193 0.91
SCHEMBL4145192 0.91
SCHEMBL9380581 0.91

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5352689-A Rhizoxin derivatives and their use as anti-tumor agents SANKYO COMPANY, LIMITED (JP) 1994-10-04 US claimed
US-5391564-A E.g., rhizoxin-13-yl 3-methylthiopropionate; anticarcinogenic agents SANKYO COMPANY, LIMITED (JP) 1995-02-21 US disclosed
US-5352689-A Rhizoxin derivatives and their use as anti-tumor agents SANKYO COMPANY, LIMITED (JP) 1994-10-04 US disclosed