SCHEMBL25009708

SCHEMBL25009708

Cc1cc(O)c(N)c(Cl)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
MAPT P10636 3/20 0.44
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSP90AA1 P07900 2/20 0.40
KMT2A Q03164 3/20 0.37
NOS3 P29474 1/20 0.37
NOS1 P29475 1/20 0.37
NOS2 P35228 1/20 0.37
NR4A2 P43354 2/20 0.35
NPC1 O15118 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
RAB9A P51151 1/20 0.33
HSP90AB1 P08238 1/20 0.33
HTT P42858 3/20 0.32
MEN1 O00255 2/20 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
SCHEMBL1886976 0.79 POLB (0.45) POLBMAPTALDH1A1MAPK1SMN1; SMN2
SCHEMBL30124712 0.79 POLB (0.45) POLBMAPTALDH1A1MAPK1SMN1; SMN2
SCHEMBL17193044 0.77 ALDH1A1 (0.45) POLBMAPTALDH1A1GAAMAPK1
SCHEMBL31211070 0.77 NOS3 (0.39) POLBMAPTALDH1A1GAASMN1; SMN2
SCHEMBL15894463 0.77 NR4A2 (0.46) POLBMAPTALDH1A1MAPK1SMN1; SMN2
SCHEMBL3886713 0.77 POLB (0.53) POLBALDH1A1GAAMAPK1SMN1; SMN2
SCHEMBL29513014 0.77 POLB (0.53) POLBALDH1A1GAAMAPK1SMN1; SMN2
SCHEMBL29672030 0.77 NR4A2 (0.46) POLBMAPTALDH1A1MAPK1SMN1; SMN2
Ammonia Solution, Strong SCHEMBL415501 0.76 POLB (0.52) POLBALDH1A1GAAMAPK1SMN1; SMN2
SCHEMBL15819409 0.74 POLB (0.46) POLBMAPTALDH1A1GAAMAPK1

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-2023014908-A1 LPAR1 ANTAGONISTS AND USES THEREOF Pipeline Therapeutics, Inc. (US) 2023-02-09 WO disclosed