SCHEMBL25834155

SCHEMBL25834155

O=c1[nH]ccc2cc(NC3CC3)ccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIT P10721 1/20 0.52
FLT3 P36888 1/20 0.52
ROCK2 O75116 6/20 0.48
ROCK1 Q13464 10/20 0.48
PRKCD Q05655 2/20 0.48
PRKACA P17612 1/20 0.48
PRKG1 Q13976 1/20 0.48
PKN1 Q16512 1/20 0.48
PKN2 Q16513 1/20 0.48
AAK1 Q2M2I8 1/20 0.48
CDC42BPA Q5VT25 1/20 0.48
Q6ZSR9 Q6ZSR9 1/20 0.48
BMP2K Q9NSY1 1/20 0.48
CDC42BPB Q9Y5S2 1/20 0.48
IP6K1 Q92551 1/20 0.47
JAK2 O60674 1/20 0.45
PRKX P51817 1/20 0.44
PRKCE Q02156 1/20 0.44
PRKD1 Q15139 1/20 0.44
CYP1A2 P05177 1/20 0.43

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
SCHEMBL1572360 0.96 KIT (0.49) KITFLT3ROCK2ROCK1PRKCD
SCHEMBL1572362 0.96 KIT (0.49) KITFLT3ROCK2ROCK1PRKCD
SCHEMBL1572022 0.93 FLT3 (0.60) KITFLT3ROCK2ROCK1PRKCD
SCHEMBL1571629 0.93 FLT3 (0.60) KITFLT3ROCK2ROCK1PRKCD
SCHEMBL1571628 0.93 FLT3 (0.60) KITFLT3ROCK2ROCK1PRKCD
SCHEMBL1571849 0.92 KIT (0.49) KITFLT3ROCK2ROCK1PRKCD
SCHEMBL1571850 0.92 KIT (0.49) KITFLT3ROCK2ROCK1PRKCD
SCHEMBL3317677 0.91 ROCK2 (0.56) KITFLT3ROCK2ROCK1PRKCD
SCHEMBL1571580 0.89 ROCK1 (0.58) KITFLT3ROCK2ROCK1PRKCD
SCHEMBL1572090 0.89 KIT (0.46) KITFLT3ROCK2ROCK1PRKCD

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-2023137356-A1 15-PGDH INHIBITORS VENTYX BIOSCIENCES, INC. (US) 2023-07-20 WO disclosed