SCHEMBL22201262

SCHEMBL22201262

CS(=O)(=O)c1ccc(-c2cc3ncccc3c(Nc3ccc4nc(C5CC5)sc4c3)n2)nc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 2/20 0.36
KDR P35968 1/20 0.36
PIP4K2A P48426 5/20 0.36
PIP4K2C Q8TBX8 5/20 0.36
P2RX3 P56373 1/20 0.35
CCNA2 P20248 2/20 0.35
CDK2 P24941 2/20 0.35
PIP4K2B P78356 2/20 0.35
TP53 P04637 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
STAT3 P40763 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
JAK3 P52333 1/20 0.34
KDM1A O60341 2/20 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
SCHEMBL22201607 0.89 RIPK2 (0.39) RIPK2KDRPIP4K2APIP4K2CTP53
SCHEMBL22201534 0.88 PIK3CD (0.40) RIPK2KDRPIP4K2APIP4K2CJAK2
SCHEMBL22201273 0.86 SYK (0.37) P2RX3ALDH1A1TSHRTGFBR1
SCHEMBL22201425 0.86 P2RX3 (0.36) P2RX3ALDH1A1JAK2TYK2JAK3
SCHEMBL22201224 0.85 P2RX3 (0.42) KDRP2RX3LMNATGFBR1
SCHEMBL22201281 0.85 SYK (0.36) P2RX3TP53ALDH1A1LMNATGFBR1
SCHEMBL22201322 0.85 PIP4K2C (0.34) PIP4K2APIP4K2CP2RX3PIP4K2BJAK2
SCHEMBL22201493 0.84 ROCK2 (0.34) P2RX3TGFBR1
SCHEMBL22201368 0.84 SYK (0.45) P2RX3ALDH1A1TGFBR1
SCHEMBL22201272 0.83 ULK1 (0.36) KDRP2RX3TGFBR1

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