SCHEMBL30452340

SCHEMBL30452340

O=C(Cc1ccc(Cl)cc1Br)C1CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.42
PYCR1 P32322 1/20 0.40
KMT2A Q03164 3/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
EPHX2 P34913 3/20 0.37
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 1/20 0.37
PPARA Q07869 1/20 0.36
MGLL Q99685 1/20 0.35
FFAR1 O14842 1/20 0.35

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
SCHEMBL24252922 1.00 NPC1 (0.42) NPC1PYCR1KMT2ALMNAMEN1
SCHEMBL30452038 0.78 KEAP1 (0.50) PYCR1PPARA
SCHEMBL30452345 0.78 PYCR1 (0.41) NPC1PYCR1KMT2ALMNAMEN1
SCHEMBL4047837 0.78 KEAP1 (0.50) PYCR1PPARA
SCHEMBL9596857 0.78 PYCR1 (0.41) NPC1PYCR1KMT2ALMNAMEN1
SCHEMBL22123456 0.77 PYCR1 (0.42) NPC1PYCR1KMT2ALMNAMEN1
SCHEMBL21612322 0.76 SIGMAR1 (0.49) KMT2ALMNAMEN1HPGDALOX12
SCHEMBL22122719 0.76 PYCR1 (0.44) NPC1PYCR1KMT2ALMNAMEN1
SCHEMBL30485967 0.76 PYCR1 (0.44) NPC1PYCR1KMT2ALMNAMEN1
SCHEMBL4706380 0.76 SIRT1 (0.45) PYCR1KMT2AMEN1SMN1; SMN2ALDH1A1

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
CN-116947903-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-10-27 CN disclosed
CN-116261564-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-06-13 CN disclosed