SCHEMBL27913601

SCHEMBL27913601

CC=C(C(=O)OCC)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
DHODH Q02127 2/20 0.48
ALDH1A1 P00352 4/20 0.47
HPGD P15428 2/20 0.47
CYP1A2 P05177 1/20 0.44
RAB9A P51151 1/20 0.44
KDM4E B2RXH2 2/20 0.44
AGTR1 P30556 1/20 0.44
GAA P10253 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL27934857 0.90 ALDH1A1 (0.57) MAPTSMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL28619132 0.90 ALDH1A1 (0.57) MAPTSMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL1336621 0.90 ALDH1A1 (0.57) MAPTSMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL9723849 0.83 DHODH (0.50) MAPTSMN1; SMN2MEN1KMT2ADHODH
SCHEMBL1172378 0.81 MAPT (0.60) MAPTSMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL27792518 0.80 KMT2A (0.57) MAPTSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL21065617 0.79 MAPT (0.57) MAPTSMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL934861 0.78 MEN1 (0.47) MAPTSMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL934862 0.78 MEN1 (0.47) MAPTSMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL15084647 0.78 ALDH1A1 (0.56) MAPTSMN1; SMN2L3MBTL1MEN1KMT2A

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
CN-103242128-B Preparation method of 9,10-dihydrophenanthrene derivatives UNIV SOOCHOW 2015-02-18 CN disclosed
CN-103242128-A Preparation method of 9,10-dihydrophenanthrene derivatives UNIV SOOCHOW 2013-08-14 CN disclosed