SCHEMBL22201368

SCHEMBL22201368

c1ccc(-c2cc3ncccc3c(Nc3ccc4nc(C5CC5)sc4c3)n2)nc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 4/20 0.45
TGFBR1 P36897 2/20 0.41
ABCG2 Q9UNQ0 4/20 0.40
ABCB1 P08183 2/20 0.40
PRKD1 Q15139 1/20 0.39
SLC2A1 P11166 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ADORA3 P0DMS8 3/20 0.38
PDE10A Q9Y233 1/20 0.38
ALDH1A1 P00352 1/20 0.37
ALOX12 P18054 1/20 0.37
P2RX3 P56373 1/20 0.36
CYP1A2 P05177 1/20 0.36
GRM4 Q14833 1/20 0.36

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
SCHEMBL22201286 0.89 P2RX3 (0.40) SYKTGFBR1PRKD1ADORA3ALDH1A1
SCHEMBL22201273 0.89 SYK (0.37) SYKTGFBR1PRKD1SLC2A1MEN1
SCHEMBL22201586 0.88 PRKCH (0.47) SYKTGFBR1ABCG2ABCB1MEN1
SCHEMBL22201224 0.88 P2RX3 (0.42) SYKTGFBR1PRKD1MEN1KMT2A
SCHEMBL22201281 0.88 SYK (0.36) SYKTGFBR1PRKD1MEN1KMT2A
SCHEMBL22201226 0.87 PRKCH (0.37) SYKTGFBR1PRKD1ADORA3PDE10A
SCHEMBL22201223 0.87 GRM4 (0.38) SYKTGFBR1PRKD1MEN1KMT2A
SCHEMBL22201366 0.87 MAPT (0.39) SYKABCG2ABCB1MEN1KMT2A
SCHEMBL22201293 0.86 SYK (0.44) SYKSLC2A1MEN1KMT2AADORA3
SCHEMBL22201302 0.86 SYK (0.44) SYKSLC2A1MEN1KMT2AALDH1A1

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-2020142748-A1 METHODS AND MATERIALS FOR INCREASING TRANSCRIPTION FACTOR EB POLYPEPTIDE LEVELS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2020-07-09 WO disclosed