SCHEMBL31661983

SCHEMBL31661983

Cc1ncn2cc(C(N)=O)c(Oc3ccc(OCCOC4CCOCC4)cc3)cc12

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.32
CNR1 P21554 1/20 0.32
CD38 P28907 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.32
JAK1 P23458 1/20 0.31
JAK3 P52333 1/20 0.31
RET P07949 3/20 0.31
HRH3 Q9Y5N1 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
OPRK1 P41145 2/20 0.31
BMPR1B O00238 1/20 0.31
BMPR1A P36894 1/20 0.31
TGFBR1 P36897 1/20 0.31
ACVRL1 P37023 1/20 0.31
ACVR1 Q04771 1/20 0.31
CSF1R P07333 1/20 0.30

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
SCHEMBL31662165 0.80 IRAK4 (0.37) CD38IRAK4JAK1JAK3RET
SCHEMBL31662205 0.78 CYP11B2 (0.34) IRAK4RETBMPR1BBMPR1ATGFBR1
SCHEMBL31661916 0.78 ICAM1 (0.34) JAK3HRH3OPRK1BMPR1BBMPR1A
SCHEMBL31662270 0.78 RET (0.36) IRAK4JAK1JAK3RETPDGFRB
SCHEMBL31661888 0.78 RET (0.36) IRAK4RET
SCHEMBL31661992 0.78 PDE4D (0.34) CSF1RPDGFRA
SCHEMBL31661957 0.78 IRAK4 (0.36) CD38IRAK4JAK1JAK3TBK1
SCHEMBL31661952 0.77 RET (0.34) CD38IRAK4RETBMPR1BBMPR1A
SCHEMBL31662142 0.77 IRAK4 (0.39) IRAK4TBK1
SCHEMBL17899405 0.77 KDM4E (0.40) HRH3SMN1; SMN2TBK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO claimed
WO-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO disclosed