SCHEMBL28524960

SCHEMBL28524960

CCCCCC=C(CCC)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.50
SOAT1 P35610 2/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C19 P33261 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
TP53 P04637 1/20 0.50
CYP3A4 P08684 1/20 0.50
CNR1 P21554 1/20 0.47
EP300 Q09472 1/20 0.47
KDM4E B2RXH2 2/20 0.46
GRIK1 P39086 1/20 0.42
TERT O14746 3/20 0.41
PTPN1 P18031 3/20 0.41
PPARG P37231 3/20 0.41
PPARD Q03181 3/20 0.41
PPARA Q07869 3/20 0.41
MAPT P10636 2/20 0.41
BLM P54132 2/20 0.41
HSD17B10 Q99714 2/20 0.41

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
SCHEMBL22583577 0.94 GRIK1 (0.47) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL8694202 0.92 FAAH (0.55) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL1503290 0.92 FAAH (0.55) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL1503292 0.92 FAAH (0.55) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL2089606 0.92 FAAH (0.55) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL4081086 0.90 FAAH (0.58) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL484135 0.90 FAAH (0.58) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL484136 0.90 FAAH (0.58) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL230509 0.90 FAAH (0.58) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL3614627 0.90 FAAH (0.58) FAAHSOAT1CYP1A2CYP2C19KMT2A

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
CN-107072993-B Pharmaceutical containing sodium-dependent phosphate transporter inhibitor 中外制药株式会社 2021-02-12 CN disclosed