SCHEMBL28868463

SCHEMBL28868463

ClCc1ccc(CCl)c(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
MAPT P10636 2/20 0.38
MCOLN3 Q8TDD5 1/20 0.38
ATP4A P20648 1/20 0.38
ATP4B P51164 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
ADORA2A P29274 3/20 0.37
ADORA1 P30542 3/20 0.37
ADORA3 P0DMS8 2/20 0.37
ADORA2B P29275 2/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
POLB P06746 2/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
HTT P42858 1/20 0.36
NPC1 O15118 2/20 0.34

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
SCHEMBL4345051 0.83 CSNK2A1 (0.42) ALDH1A1TSHR
SCHEMBL4329358 0.77 PTGER4 (0.41)
SCHEMBL30023409 0.73 CSNK2A2 (0.38) LMNAL3MBTL1KMT2AMAPTALDH1A1
SCHEMBL19002950 0.73 CSNK2A2 (0.38) LMNAL3MBTL1KMT2AMAPTALDH1A1
SCHEMBL4348835 0.73 ALDH1A1 (0.50) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL16246145 0.72 L3MBTL1 (0.61) LMNAL3MBTL1MEN1KMT2AMAPT
SCHEMBL29712512 0.72 CSNK2A1 (0.46) KMT2AALDH1A1TSHR
SCHEMBL4343394 0.71 CYP11B1 (0.50) LMNAMAPTALDH1A1HPGDALOX15
SCHEMBL4655203 0.71 NPC1 (0.33) L3MBTL1MEN1KMT2AMAPTALDH1A1
SCHEMBL19497486 0.70 L3MBTL1 (0.58) LMNAL3MBTL1MEN1KMT2AMAPT

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-109134847-A A kind of multi-component copolymer virtue amide and its preparation method and application containing side group 中国科学院化学研究所 2019-01-04 CN claimed
CN-109134847-A A kind of multi-component copolymer virtue amide and its preparation method and application containing side group 中国科学院化学研究所 2019-01-04 CN disclosed