SCHEMBL31552864

SCHEMBL31552864

Clc1ccc(N2CSc3ccccc32)c(I)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 2/20 0.34
LMNA P02545 2/20 0.34
MEN1 O00255 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
HPGD P15428 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
CYP2C19 P33261 3/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 1/20 0.33
ITGB2 P05107 1/20 0.33
ICAM1 P05362 1/20 0.33
ITGAL P20701 1/20 0.33
TP53 P04637 2/20 0.32
CYP2D6 P10635 2/20 0.32
MAPT P10636 2/20 0.32
SLC22A1 O15245 1/20 0.32
ABCB11 O95342 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
SCHEMBL16470372 0.76 LMNA (0.40) LMNAMEN1KMT2AHPGDL3MBTL1
SCHEMBL16470683 0.72 MEN1 (0.50) MEN1KMT2ATSHRDRD4DRD3
SCHEMBL27992672 0.68 ALDH1A1 (0.41) HSD17B3MEN1KMT2AHPGDL3MBTL1
SCHEMBL11995114 0.68 SIGMAR1 (0.39) HSD17B3MEN1KMT2AHPGDTP53
SCHEMBL27992895 0.67 HSD17B3 (0.35) HSD17B3MEN1HTTKMT2AHPGD
SCHEMBL27860575 0.66 HTR7 (0.42) HTTHPGDHTR1AHTR2AMAPK1
SCHEMBL16470043 0.66 HSD17B10 (0.42) LMNAMEN1KMT2AHPGDBCHE
SCHEMBL28842681 0.65 BCHE (0.46) LMNAHPGDL3MBTL1BCHEACHE
SCHEMBL16470622 0.64 HTR3A (0.40) HPGDBCHECYP2C19CYP1A2CYP2C9
SCHEMBL27697616 0.63 NOTUM (0.38) HSD17B3LMNAKMT2AHPGDL3MBTL1

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-2025061927-A1 METHOD OF MAKING LANIFIBRANOR INVENTIVA (FR) 2025-03-27 WO disclosed