SCHEMBL31387201

SCHEMBL31387201

Cc1cccc(-c2csc(N)n2)n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.61
CCR8 P51685 1/20 0.61
FBP1 P09467 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.52
NOS1 P29475 1/20 0.52
ALDH1A1 P00352 6/20 0.52
MAPT P10636 6/20 0.52
NPC1 O15118 4/20 0.52
HSD17B10 Q99714 4/20 0.52
GFER P55789 1/20 0.52
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
RAB9A P51151 3/20 0.47
CYP3A4 P08684 2/20 0.47
KDM4E B2RXH2 2/20 0.47
LMNA P02545 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL2483921 1.00 CCR1 (0.61) CCR1CCR8FBP1SMN1; SMN2NOS1
SCHEMBL13951860 0.82 CCR1 (0.64) CCR1CCR8SMN1; SMN2ALDH1A1MAPT
SCHEMBL13377856 0.81 CCR1 (0.61) CCR1CCR8SMN1; SMN2ALDH1A1MAPT
SCHEMBL8498361 0.79 CCR1 (0.59) CCR1CCR8FBP1SMN1; SMN2ALDH1A1
SCHEMBL23705329 0.79 FBP1 (0.46) FBP1SMN1; SMN2NOS1ALDH1A1MAPT
SCHEMBL29388304 0.78 CCR1 (1.00) CCR1CCR8SMN1; SMN2ALDH1A1NPC1
SCHEMBL30511194 0.78 CCR1 (1.00) CCR1CCR8SMN1; SMN2ALDH1A1NPC1
SCHEMBL196966 0.78 CCR1 (1.00) CCR1CCR8SMN1; SMN2ALDH1A1NPC1
SCHEMBL21516180 0.77 FBP1 (0.58) FBP1SMN1; SMN2ALDH1A1MAPTNPC1
SCHEMBL22290651 0.77 MAPT (0.54) FBP1SMN1; SMN2ALDH1A1MAPTNPC1

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-119255993-A Thiazole derivative compound and use thereof 奥托泰利克生物公司 2025-01-03 CN disclosed