SCHEMBL9258680

SCHEMBL9258680

C#CC(O)(c1cc2ccccc2o1)c1ccccc1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.41
NPC1 O15118 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CYP19A1 P11511 2/20 0.41
HPGD P15428 5/20 0.39
ALDH1A1 P00352 4/20 0.39
MAPT P10636 3/20 0.39
MAOB P27338 3/20 0.39
GAA P10253 1/20 0.39
HTR1A P08908 1/20 0.38
DRD2 P14416 1/20 0.38
HTR2B P41595 1/20 0.38
HSD17B10 Q99714 4/20 0.37
TDP1 Q9NUW8 2/20 0.37
TP53 P04637 2/20 0.37
POLB P06746 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL9258611 0.80 CYP19A1 (0.41) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL7489674 0.78 CA1 (0.46) MEN1KMT2AL3MBTL1HPGDALDH1A1
SCHEMBL9251887 0.77 CYP19A1 (0.43) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL9101266 0.73 MAPT (0.41) NPC1SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL11574544 0.72 ALDH1A1 (0.41) SMN1; SMN2MEN1KMT2ACYP19A1ALDH1A1
SCHEMBL6071101 0.71 RAB9A (0.47) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL8102819 0.71 CYP1A2 (0.43) L3MBTL1HPGDALDH1A1MAPTGAA
SCHEMBL30057200 0.69 MAPT (0.44) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL8036000 0.68 KDM4E (0.46) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL7552122 0.68 NFE2L2 (0.43) RAB9ASMN1; SMN2MEN1KMT2AALDH1A1

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-5429774-A FOR USE IN PHOTOCHROMIC ARTICLES TRANSITIONS OPTICAL, INC. (US) 1995-07-04 US disclosed