SCHEMBL4694040

SCHEMBL4694040

CC(C)CC(=O)NC1(C(N)=O)CCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
CYP2D6 P10635 1/20 0.35
KDM4E B2RXH2 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
TP53 P04637 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33
PTPN1 P18031 1/20 0.33
P2RX7 Q99572 1/20 0.32
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
GAA P10253 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CTSS P25774 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
TACR2 P21452 1/20 0.31

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
SCHEMBL13502740 0.83 SPHK1 (0.37) ALDH1A1CYP2D6KDM4EKMT2ASPHK1
SCHEMBL5112211 0.82 CNR2 (0.36) ALDH1A1SMN1; SMN2TP53CTSLCTSB
SCHEMBL20366215 0.80 SPHK1 (0.36) ALDH1A1CYP2D6KDM4EKMT2ASPHK1
SCHEMBL21083751 0.79 SPHK1 (0.38) ALDH1A1CYP2D6KDM4EKMT2ASMN1; SMN2
SCHEMBL30389190 0.78 SPHK1 (0.37) ALDH1A1KDM4EKMT2ASMN1; SMN2SPHK1
SCHEMBL21083999 0.76 SPHK1 (0.46) KDM4EKMT2ASPHK1P2RX7CTSL
SCHEMBL20054142 0.76 PTPN1 (0.37) ALDH1A1KDM4EKMT2ASMN1; SMN2TP53
SCHEMBL21083984 0.76 KMT2A (0.37) ALDH1A1CYP2D6KDM4EKMT2ASMN1; SMN2
SCHEMBL15125084 0.76 SMN1; SMN2 (0.36) ALDH1A1KDM4EKMT2ASMN1; SMN2TP53
SCHEMBL20221443 0.75 SPHK1 (0.45) ALDH1A1KDM4EKMT2ASMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1919469-A2 PROCESS FOR PREPARING AN ANGIOTENSIN II RECEPTOR ANTAGONIST Farmaprojects, S.A. (ES) 2008-05-14 EP disclosed
WO-2007017469-A2 PROCESS FOR PREPARING AN ANGIOTENSIN II RECEPTOR ANTAGONIST FARMAPROJECTS, S. A. (ES) 2007-02-15 WO disclosed