SCHEMBL9618273

SCHEMBL9618273

CCCCC/C(=C/C(N)=O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.46
FAAH O00519 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
SOAT1 P35610 1/20 0.46
GPR84 Q9NQS5 7/20 0.45
PPARG P37231 7/20 0.45
PPARD Q03181 7/20 0.45
PPARA Q07869 7/20 0.45
HDAC11 Q96DB2 5/20 0.45
TSHR P16473 4/20 0.45
PTPN1 P18031 3/20 0.45
ALDH1A1 P00352 2/20 0.45
TLR2 O60603 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
FABP4 P15090 2/20 0.45

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
SCHEMBL9618275 1.00 AKR1B1 (0.46) AKR1B1FAAHMEN1KMT2ATP53
SCHEMBL10433254 0.98 MEN1 (0.48) AKR1B1FAAHMEN1KMT2ATP53
SCHEMBL9360654 0.98 MEN1 (0.48) AKR1B1FAAHMEN1KMT2ATP53
SCHEMBL9359946 0.98 MEN1 (0.48) AKR1B1FAAHMEN1KMT2ATP53
SCHEMBL1289324 0.98 MEN1 (0.48) AKR1B1FAAHMEN1KMT2ATP53
SCHEMBL9359672 0.98 MEN1 (0.48) AKR1B1FAAHMEN1KMT2ATP53
SCHEMBL9364020 0.98 MEN1 (0.48) AKR1B1FAAHMEN1KMT2ATP53
SCHEMBL7191250 0.98 MEN1 (0.48) AKR1B1FAAHMEN1KMT2ATP53
SCHEMBL22528548 0.98 MEN1 (0.48) AKR1B1FAAHMEN1KMT2ATP53
SCHEMBL9643885 0.98 MEN1 (0.48) AKR1B1FAAHMEN1KMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4290868-A None JP disclosed
JP-H04290868-A PRODUCTION OF N-ARYLMALEIMIDE TOSOH CORP 1992-10-15 JP disclosed
US-5115061-A N-propionitrile maleimides, preparation process and polymers thereof GENERAL ELECTRIC COMPANY (US) 1992-05-19 US disclosed
EP-0080451-B1 METHOD AND COMPOSITION FOR DIENE RUBBER TREATMENT MONSANTO COMPANY (US) 1985-09-18 EP disclosed
US-4433114-A SULFUR OR ORGANOSULFUR COMPOUNDS, MALEAMIC ACID OR DERIVATIVES, TACKINESS, GREEN STRENGTH MONSANTO COMPANY (US) 1984-02-21 US disclosed
EP-0080451-A1 Method and composition for diene rubber treatment MONSANTO COMPANY (US) 1983-06-01 EP disclosed