SCHEMBL8945465

SCHEMBL8945465

CCN(CC)C(=O)Oc1ccc(Cc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.71
KMT2A Q03164 2/20 0.71
HSD17B10 Q99714 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
LTA4H P09960 2/20 0.53
LMNA P02545 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
HTT P42858 1/20 0.49
ELANE P08246 1/20 0.47
MAOA P21397 2/20 0.47
SRD5A1 P18405 1/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL5623546 0.86 MEN1 (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL7558815 0.85 SRD5A1 (0.53) MEN1KMT2ALTA4HLMNAL3MBTL1
SCHEMBL9302685 0.84 MEN1 (1.00) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL27503951 0.83 MEN1 (0.76) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL723132 0.83 RAB9A (0.66) KMT2ALTA4HLMNAELANEALDH1A1
SCHEMBL10515358 0.82 MEN1 (0.62) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL16556312 0.81 KMT2A (0.71) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL6459728 0.80 PPARG (0.47) KMT2ALTA4HLMNAL3MBTL1ELANE
SCHEMBL11307504 0.80 KMT2A (0.69) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL5649619 0.79 RAB9A (0.66) MEN1KMT2ASMN1; SMN2LTA4HLMNA

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
US-5510375-A VIRICIDES TREATING INFECTION CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS AND AIDS WARNER-LAMBERT COMPANY (US) 1996-04-23 US disclosed