SCHEMBL30217825

SCHEMBL30217825

Cc1nc2cccc(Br)c2nc1Cl

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
PIM1 P11309 1/20 0.40
PIM2 Q9P1W9 1/20 0.40
PDPK1 O15530 1/20 0.37
TDP1 Q9NUW8 1/20 0.35
BACE1 P56817 2/20 0.35
NQO2 P16083 6/20 0.35
ENPP3 O14638 1/20 0.35
ENPP1 P22413 1/20 0.35
GPR3 P46089 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PKMYT1 Q99640 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33

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
SCHEMBL14764386 1.00 ALDH1A1 (0.42) ALDH1A1PIM1PIM2PDPK1TDP1
SCHEMBL14764722 0.93 ALDH1A1 (0.45) ALDH1A1PIM1PIM2PDPK1TDP1
SCHEMBL2513088 0.84 MAPT (0.44) ALDH1A1TDP1BACE1NQO2GPR3
SCHEMBL30217623 0.84 MAPT (0.44) ALDH1A1TDP1BACE1NQO2GPR3
SCHEMBL15228704 0.84 TDP1 (0.52) ALDH1A1PDPK1TDP1BACE1NQO2
SCHEMBL14764415 0.81 MAPT (0.44) ALDH1A1PIM1PIM2TDP1NQO2
SCHEMBL4181275 0.81 NR1H2 (0.43) PIM1PIM2TDP1NQO2GPR3
SCHEMBL27897958 0.81 ALDH1A1 (0.37) ALDH1A1TDP1BACE1NQO2GPR3
SCHEMBL14734341 0.78 PIM1 (0.40) ALDH1A1PIM1PIM2TDP1NQO2
SCHEMBL15228611 0.78 BACE1 (0.43) ALDH1A1PDPK1TDP1BACE1NQO2

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
EP-4395891-A1 COMPOUNDS AND METHODS FOR MODULATING SPLICING Remix Therapeutics Inc. (US) 2024-07-10 EP disclosed
WO-2023034811-A1 COMPOUNDS AND METHODS FOR MODULATING SPLICING REMIX THERAPEUTICS INC. (US) 2023-03-09 WO disclosed