SCHEMBL25524005

SCHEMBL25524005

Cc1ccnc2cc(-c3cnc(C(C)C)c(O)c3)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 4/20 0.41
▸ RET P07949 1/20 0.34
▸ RIPK1 Q13546 1/20 0.34
▸ RIPK3 Q9Y572 1/20 0.34
▸ RIPK2 O43353 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ TGFBR1 P36897 1/20 0.33
▸ CCR1 P32246 1/20 0.33
▸ CCR5 P51681 1/20 0.33
▸ CCR8 P51685 1/20 0.33
▸ PDGFRB P09619 1/20 0.33
▸ PDGFRA P16234 1/20 0.33
▸ ALK Q9UM73 2/20 0.33
▸ F2 P00734 1/20 0.33
▸ PLG P00747 1/20 0.33
▸ PRSS1 P07477 1/20 0.33
▸ CSF1R P07333 2/20 0.32
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32

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
SCHEMBL25520064 0.82 TLR8 (0.44) TLR8RETRIPK1RIPK3RIPK2
SCHEMBL25522057 0.82 TGFBR1 (0.40) TLR8EGFRTGFBR1
SCHEMBL25523900 0.78 RAF1 (0.39) PDGFRBPDGFRA
SCHEMBL25522336 0.77 TLR8 (0.40) TLR8RETRIPK1RIPK3RIPK2
SCHEMBL25523956 0.76 MAPKAPK2 (0.44) RETRIPK2
SCHEMBL25524046 0.75 TGFBR1 (0.44) EGFRTGFBR1
SCHEMBL25522060 0.73 HSP90AA1 (0.34) TLR8CCR1CCR5CCR8
SCHEMBL25524010 0.72 CYP1A2 (0.41) EGFRPDGFRBPDGFRA
SCHEMBL25524007 0.71 PDGFRB (0.40) EGFRPDGFRBPDGFRACA1CA2
SCHEMBL25519630 0.69 AURKA (0.49) TLR8RETTGFBR1CCR1CCR5

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-2023086428-A2 NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) 2023-05-19 — — WO disclosed
Send feedback