SCHEMBL31435488

SCHEMBL31435488

Cc1ccc(C(=O)n2ccc3ccccc32)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.75
TSHR P16473 1/20 0.75
L3MBTL1 Q9Y468 1/20 0.75
NOTUM Q6P988 1/20 0.59
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.54
HTT P42858 1/20 0.54
KDM4E B2RXH2 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
NPC1 O15118 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
PKM P14618 1/20 0.49
NOD2 Q9HC29 1/20 0.47
NOD1 Q9Y239 1/20 0.47
BCHE P06276 1/20 0.46
NAMPT P43490 1/20 0.46
PPARG P37231 1/20 0.44
ALDH1A1 P00352 1/20 0.43
HPGD P15428 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
SCHEMBL1413391 0.86 RAB9A (1.00) RAB9ATSHRL3MBTL1NOTUMLMNA
SCHEMBL31435512 0.86 RAB9A (1.00) RAB9ATSHRL3MBTL1NOTUMLMNA
SCHEMBL6587897 0.83 RAB9A (0.75) RAB9ATSHRL3MBTL1NOTUMMAPT
SCHEMBL5431558 0.81 RAB9A (0.66) RAB9ATSHRL3MBTL1NOTUMMAPT
SCHEMBL31435524 0.80 TSHR (0.70) RAB9ATSHRL3MBTL1NOTUMLMNA
SCHEMBL9263968 0.80 TSHR (0.75) RAB9ATSHRL3MBTL1NOTUMLMNA
SCHEMBL28243567 0.80 TSHR (0.69) RAB9ATSHRL3MBTL1NOTUMMEN1
SCHEMBL7010604 0.80 TSHR (0.69) RAB9ATSHRL3MBTL1NOTUMMAPT
SCHEMBL29936456 0.76 TSHR (0.51) RAB9ATSHRL3MBTL1NOTUMLMNA
SCHEMBL28835540 0.76 TSHR (0.51) RAB9ATSHRL3MBTL1NOTUMLMNA

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
CN-119661415-A Indole derivative obtained by converting quinoline nitrogen-oxide and synthetic method thereof 上海交通大学 2025-03-21 CN disclosed