SCHEMBL28985992

SCHEMBL28985992

CC(C)c1ccc(C(=O)NCc2c[nH]nc2-c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.47
SMN1; SMN2 Q16637 6/20 0.47
NPC1 O15118 6/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 3/20 0.44
TP53 P04637 2/20 0.44
HPGD P15428 2/20 0.42
ROCK2 O75116 1/20 0.42
ROCK1 Q13464 1/20 0.42
TRPV1 Q8NER1 2/20 0.42
MMP13 P45452 1/20 0.41
MAPT P10636 2/20 0.41
EPHX2 P34913 1/20 0.41
PPARG P37231 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL28986010 0.87 LMNA (0.50) RAB9ASMN1; SMN2NPC1ALDH1A1HTT
SCHEMBL28986053 0.86 PPARG (0.49) RAB9ASMN1; SMN2NPC1HTTEPHX2
SCHEMBL28986037 0.86 RAB9A (0.58) RAB9ANPC1ALDH1A1HTTMEN1
SCHEMBL28986044 0.85 TAOK1 (0.48) RAB9ASMN1; SMN2NPC1HTTLMNA
SCHEMBL28986045 0.84 KMT2A (0.47) RAB9ASMN1; SMN2NPC1ALDH1A1HTT
SCHEMBL28986036 0.83 HDAC3 (0.48) RAB9ASMN1; SMN2NPC1HTTLMNA
SCHEMBL28986000 0.81 TRPV1 (0.50) RAB9ANPC1HTTMEN1KMT2A
SCHEMBL28986008 0.81 EPHX2 (0.50) RAB9ASMN1; SMN2NPC1HTTMEN1
SCHEMBL28986005 0.80 TRPV1 (0.53) RAB9ANPC1HTTMEN1KMT2A
SCHEMBL28985996 0.79 TRPV1 (0.52) ALDH1A1MEN1KMT2ATRPV1MAPT

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-115960047-B 3-Phenyl-1H-pyrazole compound and application thereof 中国药科大学 2025-04-15 CN disclosed
CN-115960047-A 3-phenyl-1H-pyrazole compound and application thereof 中国药科大学 2023-04-14 CN disclosed