SCHEMBL22201415

SCHEMBL22201415

Cc1ncccc1Nc1cc2ncccc2c(Nc2ccc3nc(C4CC4)sc3c2)n1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIP4K2A P48426 2/20 0.37
PIP4K2C Q8TBX8 2/20 0.37
TGFBR1 P36897 2/20 0.36
P2RX3 P56373 5/20 0.36
TYK2 P29597 7/20 0.35
JAK3 P52333 7/20 0.35
JAK2 O60674 5/20 0.35
PRKD1 Q15139 1/20 0.35
JAK1 P23458 4/20 0.34
PARP14 Q460N5 1/20 0.34
P2RX2 Q9UBL9 1/20 0.34
ALDH1A1 P00352 1/20 0.34
ALOX12 P18054 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP1A2 P05177 1/20 0.34
GRM4 Q14833 1/20 0.34

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
SCHEMBL22201236 0.88 KDM4E (0.36) TGFBR1P2RX3TYK2JAK3JAK2
SCHEMBL22201537 0.86 KDM4E (0.42) PIP4K2APIP4K2CTGFBR1P2RX3ALDH1A1
SCHEMBL22201239 0.84 PDE5A (0.39) TGFBR1P2RX3TYK2JAK3JAK2
SCHEMBL22201416 0.82 MEN1 (0.44) MEN1KMT2A
SCHEMBL22201242 0.82 HTR2C (0.38) PIP4K2APIP4K2CTGFBR1P2RX3PRKD1
SCHEMBL22201365 0.82 ADORA3 (0.38) TGFBR1P2RX3TYK2JAK3JAK2
SCHEMBL22201319 0.80 CYP1A2 (0.42) TGFBR1P2RX3PRKD1ALDH1A1ALOX12
SCHEMBL22201368 0.80 SYK (0.45) TGFBR1P2RX3PRKD1ALDH1A1ALOX12
SCHEMBL22201586 0.79 PRKCH (0.47) TGFBR1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL22201392 0.78 ALOX12 (0.40) TGFBR1P2RX3PRKD1ALDH1A1ALOX12

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