SCHEMBL30323375

SCHEMBL30323375

COC(=O)c1c(Br)nn2c1CCC2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.49
▸ KMT2A Q03164 4/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ ALDH1A1 P00352 7/20 0.44
▸ LMNA P02545 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ HPGD P15428 3/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ TGFBR1 P36897 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ CNR2 P34972 1/20 0.32

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
SCHEMBL21081513 0.78 MAPK1 (0.46) MAPK1KMT2AMEN1ALDH1A1LMNA
SCHEMBL23414986 0.77 ALDH1A1 (0.48) MAPK1KMT2AMEN1ALDH1A1LMNA
SCHEMBL31714739 0.77 ALDH1A1 (0.45) MAPK1KMT2AMEN1ALDH1A1LMNA
SCHEMBL29852457 0.76 ALDH1A1 (0.44) MAPK1KMT2AMEN1ALDH1A1LMNA
SCHEMBL31053388 0.74 ALDH1A1 (0.42) MAPK1KMT2AMEN1ALDH1A1LMNA
SCHEMBL31158416 0.72 MAPK1 (0.42) MAPK1KMT2AMEN1ALDH1A1LMNA
SCHEMBL31158519 0.69 MAPK1 (0.39) MAPK1KMT2AMEN1ALDH1A1LMNA
SCHEMBL30323467 0.69 BRD4 (0.45) MAPK1KMT2AMEN1TLR2
SCHEMBL31066451 0.68 ALDH1A1 (0.39) MAPK1KMT2AMEN1ALDH1A1LMNA
SCHEMBL16794181 0.67 DRD3 (0.52) MAPK1KMT2AMEN1ALDH1A1LMNA

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
WO-2023049199-A1 AZOLE COMPOUNDS ZENO MANAGEMENT, INC. (US) 2023-03-30 — — WO disclosed
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