SCHEMBL31590887

SCHEMBL31590887

Oc1cc(CBr)c2ccc(Cl)cc2n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
NR4A2 P43354 2/20 0.40
KMT2A Q03164 3/20 0.38
MPO P05164 1/20 0.38
BCHE P06276 2/20 0.36
ACHE P22303 2/20 0.36
CHRM1 P11229 1/20 0.36
EPHX2 P34913 1/20 0.36
MAPT P10636 3/20 0.36
MEN1 O00255 2/20 0.36
HPGD P15428 2/20 0.36
HTT P42858 2/20 0.36
SLC22A1 O15245 1/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
HSP90AA1 P07900 1/20 0.36
CYP3A4 P08684 1/20 0.36
HSPD1 P10809 1/20 0.36
HSPA5 P11021 1/20 0.36
IDO1 P14902 1/20 0.36

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
SCHEMBL2417822 1.00 POLB (0.42) POLBNR4A2KMT2AMPOBCHE
SCHEMBL11346258 0.88 ALDH1A1 (0.39) KMT2AMPOBCHEACHEMAPT
SCHEMBL27753764 0.87 POLB (0.40) POLBNR4A2KMT2AMPOBCHE
SCHEMBL2419272 0.82 POLB (0.44) POLBNR4A2KMT2AMPOBCHE
SCHEMBL8127677 0.78 POLB (0.47) POLBNR4A2KMT2AMPOBCHE
SCHEMBL11341944 0.77 ELANE (0.42) POLBKMT2AACHECHRM1MAPT
SCHEMBL8936165 0.76 POLB (0.42) POLBNR4A2KMT2AACHECHRM1
SCHEMBL31590436 0.72 MOK (0.58) POLBKMT2AMAPTHTTLMNA
SCHEMBL31716536 0.71 ALDH1A1 (0.51) POLBKMT2AHPGDCASP1SMN1; SMN2
SCHEMBL11347720 0.70 KDM4E (0.40) NR4A2MPOBCHEACHEMAPT

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-120051459-A Quinoline compounds as modulators of RAGE activity and uses thereof 纽约大学 2025-05-27 CN disclosed