SCHEMBL30714286

SCHEMBL30714286

CC(C)c1cc(Br)ccc1SCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
SLC6A4 P31645 1/20 0.39
MAOB P27338 3/20 0.36
MAOA P21397 2/20 0.36
S100A4 P26447 1/20 0.36
RAB9A P51151 3/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.35
PTPRC P08575 2/20 0.35
GSTP1 P09211 1/20 0.35
GSTM2 P28161 1/20 0.35
CCR5 P51681 1/20 0.35
PTPRG P23470 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 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
SCHEMBL25299214 0.84 POLB (0.42) POLBMAOBMAOAS100A4RAB9A
SCHEMBL31727235 0.81 MAOA (0.53) POLBSLC6A4MAOBMAOAL3MBTL1
SCHEMBL18791153 0.76 POLB (0.46) POLBS100A4RAB9AKMT2ANPC1
SCHEMBL27177273 0.75 ALDH1A1 (0.46) POLBRAB9AKMT2AL3MBTL1MEN1
SCHEMBL10394742 0.73 MAOB (0.41) POLBSLC6A4MAOBMAOARAB9A
SCHEMBL18864972 0.72 MAOB (0.58) POLBMAOBMAOAKMT2AL3MBTL1
SCHEMBL23585595 0.72 ALDH1A1 (0.46) POLBRAB9AKMT2AL3MBTL1MEN1
SCHEMBL21760572 0.70 POLB (0.43) POLBMAOBMAOARAB9ANPC1
SCHEMBL17927664 0.70 POLB (0.37) POLBS100A4RAB9AKMT2ANPC1
SCHEMBL30016479 0.70 PTPRC (0.54) POLBMAOBMAOARAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025136671-A1 ANILINO-PYRAZOLE DERIVATIVES, COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2025-06-26 WO disclosed
EP-4540230-A1 ANILINO-PYRAZOLE DERIVATIVES, COMPOSITIONS AND METHODS THEREOF Ensem Therapeutics, Inc. (US) 2025-04-23 EP disclosed
CN-119384413-A Anilino-pyrazole derivatives, compositions and methods thereof 昂胜医药有限公司 2025-01-28 CN disclosed
WO-2023244710-A1 ANILINO-PYRAZOLE DERIVATIVES, COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2023-12-21 WO disclosed