SCHEMBL28937334

SCHEMBL28937334

Clc1ccc(Oc2ccc(NN=Cc3ccc(Br)cc3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.58
RAB9A P51151 8/20 0.58
KMT2A Q03164 7/20 0.58
GAA P10253 6/20 0.58
MEN1 O00255 6/20 0.58
LMNA P02545 4/20 0.58
HPGD P15428 2/20 0.58
NPC1 O15118 7/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
PKM P14618 2/20 0.47
ATM Q13315 2/20 0.47
ALDH1A1 P00352 1/20 0.47
GFER P55789 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
USP2 O75604 1/20 0.45
XBP1 P17861 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 3/20 0.43
MAPK1 P28482 2/20 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
SCHEMBL8265016 0.85 MAPT (0.81) MAPTRAB9AKMT2AGAAMEN1
SCHEMBL13875563 0.80 MAPT (0.63) MAPTRAB9AKMT2AGAAMEN1
SCHEMBL8265977 0.79 MAPT (0.67) MAPTRAB9AKMT2AGAAMEN1
SCHEMBL21626718 0.77 MAPT (0.73) MAPTRAB9AKMT2AGAAMEN1
SCHEMBL21626681 0.77 RAB9A (0.73) MAPTRAB9AKMT2AGAAMEN1
SCHEMBL8264561 0.76 MAPT (0.57) MAPTRAB9AKMT2AGAAMEN1
SCHEMBL6614179 0.75 MAOA (0.58) MAPTKMT2AMEN1LMNAHPGD
SCHEMBL6081637 0.74 NOX1 (0.69) MAPTRAB9AKMT2AGAAMEN1
SCHEMBL1729594 0.74 NOX1 (0.69) MAPTRAB9AKMT2AGAAMEN1
SCHEMBL11673800 0.74 MAPT (1.00) MAPTRAB9AKMT2AGAAMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119350257-A Triazole compounds 广西医科大学 2025-01-24 CN disclosed
CN-115594642-B A Ji Ruige triazole derivative and application thereof in resisting breast cancer 广西医科大学 2024-12-27 CN disclosed
CN-115594642-A Az Ji Ruige triazole derivative and application thereof in resisting breast cancer 广西医科大学(CN) 2023-01-13 CN disclosed