SCHEMBL2899844

SCHEMBL2899844

COCCOCCOc1ccccc1-c1ccsc1Br

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.43
ADRB2 P07550 2/20 0.43
ADRB1 P08588 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 4/20 0.41
MAPT P10636 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTR7 P34969 1/20 0.40
KCNN4 O15554 1/20 0.39
ALDH1A1 P00352 3/20 0.39
LMNA P02545 3/20 0.39
KDM4E B2RXH2 3/20 0.38
POLB P06746 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL13515438 0.84 AR (0.42) ARADRB2ADRB1SMN1; SMN2MEN1
SCHEMBL5572014 0.82 ALDH1A1 (0.39) ARSMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL19578633 0.82 ALDH1A1 (0.39) ARSMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL478309 0.79 HTR7 (0.56) ARADRB2ADRB1SMN1; SMN2MEN1
SCHEMBL22261451 0.78 APP (0.48) SMN1; SMN2MEN1KMT2AL3MBTL1HTR7
SCHEMBL5349206 0.76 L3MBTL1 (0.61) ARADRB2ADRB1SMN1; SMN2KMT2A
SCHEMBL4101620 0.76 L3MBTL1 (0.61) ARADRB2ADRB1SMN1; SMN2KMT2A
SCHEMBL2896629 0.75 MAPT (0.63) SMN1; SMN2KMT2AL3MBTL1MAPTTDP1
SCHEMBL24478619 0.74 AR (0.43) ARADRB2ADRB1SMN1; SMN2MEN1
SCHEMBL2898794 0.74 ADRB2 (0.49) ARADRB2ADRB1SMN1; SMN2MEN1

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
US-20100009066-A1 Waterbased compositions for casting or printing ACREO AB (SE) 2010-01-14 US disclosed
EP-2143767-A1 Waterbased compositions for casting or printing Acreo AB (SE) 2010-01-13 EP disclosed