SCHEMBL29429702

SCHEMBL29429702

CC(=O)c1cnc(Cn2c(=O)c3c(ncn3C)n(C)c2=O)cn1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 7/20 0.60
TNF P01375 4/20 0.56
USP2 O75604 1/20 0.56
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.56
TSHR P16473 1/20 0.56
NFKB1 P19838 1/20 0.56
ACHE P22303 1/20 0.56
PDE4A P27815 1/20 0.56
PMP22 Q01453 1/20 0.56
PDE4B Q07343 1/20 0.56
PDE4C Q08493 1/20 0.56
PDE4D Q08499 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
GLA P06280 1/20 0.51
BLM P54132 1/20 0.51
MAPK1 P28482 1/20 0.49

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
SCHEMBL17682269 1.00 ADORA2B (0.60) ADORA2BTNFUSP2LMNACYP1A2
SCHEMBL30025066 0.84 ADORA2B (0.60) ADORA2BTNFUSP2LMNACYP1A2
SCHEMBL30025359 0.84 ADORA2B (0.60) ADORA2BTNFUSP2LMNACYP1A2
SCHEMBL17682197 0.84 ADORA2B (0.60) ADORA2BTNFUSP2LMNACYP1A2
SCHEMBL17682294 0.84 ADORA2B (0.60) ADORA2BTNFUSP2LMNACYP1A2
SCHEMBL19601317 0.81 ADORA2B (0.53) ADORA2BTNFUSP2LMNACYP1A2
SCHEMBL17682296 0.78 ADORA2B (0.59) ADORA2BTNFUSP2LMNACYP1A2
SCHEMBL18819716 0.78 ADORA2B (0.62) ADORA2BTNFUSP2LMNACYP1A2
SCHEMBL17682172 0.77 ADORA2B (0.58) ADORA2BTNFUSP2LMNACYP1A2
SCHEMBL17682262 0.77 ADORA2B (0.49) ADORA2BTNFUSP2LMNACYP1A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111233863-B Hydroxyl purine compound and application thereof 广东众生睿创生物科技有限公司 2022-10-25 CN disclosed
US-RE49128-E1 Hydroxyl purine compounds and applications thereof Guangdong Raynovent Biotech Co., Ltd. (CN) 2022-07-12 US disclosed
EP-3205652-B1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF GUANGDONG RAYNOVENT BIOTECH CO LTD (CN) 2022-03-09 EP disclosed