SCHEMBL28097567

SCHEMBL28097567

Cc1ccc(C(=O)O)c(-c2cccc(CN)c2CBr)c1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.40
FOLH1 Q04609 2/20 0.36
CD274 Q9NZQ7 1/20 0.33
HMGB1 P09429 1/20 0.33
TYMS P04818 1/20 0.33
POLB P06746 1/20 0.33
DPP4 P27487 1/20 0.33
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
LMNA P02545 1/20 0.32
CLCN2 P51788 1/20 0.32
MCL1 Q07820 1/20 0.32
SLC16A3 O15427 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PKM P14618 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL28203200 0.90 MYC (0.39) MYCFOLH1TYMSPOLBALDH1A1
SCHEMBL28097579 0.86 MYC (0.45) MYCFOLH1TYMSPOLBALDH1A1
SCHEMBL28019280 0.86 MYC (0.39) MYCFOLH1CD274HMGB1TYMS
SCHEMBL27875990 0.84 MYC (0.46) MYCFOLH1POLBDPP4ALDH1A1
SCHEMBL28097596 0.84 MYC (0.40) MYCFOLH1TYMSPOLBALDH1A1
SCHEMBL28097556 0.82 MYC (0.39) MYCPOLBALDH1A1MAPTLMNA
SCHEMBL28014917 0.81 MYC (0.47) MYCFOLH1CD274TYMSDPP4
SCHEMBL28098434 0.81 MYC (0.40) MYCFOLH1CD274HMGB1TYMS
SCHEMBL28202955 0.81 CA12 (0.44) MYCCD274POLBALDH1A1MAPT
SCHEMBL27403003 0.76 MYC (0.45) MYCFOLH1ALDH1A1MAPTL3MBTL1

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-104884442-B Terazololine-one compound and application thereof 住友化学株式会社 2016-11-02 CN disclosed