SCHEMBL11547196

SCHEMBL11547196

Cc1cccc2occ(-c3ccccc3)c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.46
ADORA2A P29274 2/20 0.46
PIN1 Q13526 2/20 0.41
ENPP3 O14638 1/20 0.41
ENPP1 P22413 1/20 0.41
ALDH1A1 P00352 7/20 0.40
SMN1; SMN2 Q16637 6/20 0.40
MAPT P10636 5/20 0.40
HPGD P15428 5/20 0.40
TP53 P04637 4/20 0.40
CYP3A4 P08684 3/20 0.40
HSD17B10 Q99714 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
USP2 O75604 2/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
BRCA1 P38398 1/20 0.40
BLM P54132 1/20 0.40
KDM4E B2RXH2 5/20 0.39

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
SCHEMBL7616214 0.86 ADORA2A (0.58) THRBADORA2AALDH1A1SMN1; SMN2MAPT
SCHEMBL28623019 0.82 ALDH1A1 (0.42) THRBPIN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL3611718 0.79 THRB (0.50) THRBPIN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL11745010 0.78 ALDH1A1 (0.50) ADORA2APIN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL1742326 0.77 KDM4E (0.52) THRBPIN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL5989965 0.76 ALDH1A1 (0.60) THRBADORA2APIN1ALDH1A1SMN1; SMN2
SCHEMBL8404358 0.76 ADORA2A (0.45) ADORA2AALDH1A1MAPTBLMPOLB
SCHEMBL19010384 0.76 ALDH1A1 (0.44) THRBADORA2AENPP3ENPP1ALDH1A1
SCHEMBL11542296 0.75 ADORA2A (0.43) ADORA2AALDH1A1HPGDHSD17B10USP2
SCHEMBL9925450 0.75 PIN1 (0.49) THRBPIN1ALDH1A1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118852134-A 3-Phenyl-4-formate substituted benzofuran derivatives, preparation method, pharmaceutical composition and application thereof 中国医学科学院药物研究所 2024-10-29 CN disclosed
US-4153619-A MICROBIOCIDES RIKER LABORATORIES, INC. (US) 1979-05-08 US disclosed
US-4141990-A BACTERICIDES, FUNGICIDES RIKER LABORATORIES, INC. (US) 1979-02-27 US disclosed
US-4124704-A ANTIMICROBIAL RIKER LABORATORIES, INC. (US) 1978-11-07 US disclosed