SCHEMBL23316404

SCHEMBL23316404

Cc1cn2cc(B3OC(C)(C)C(C)(C)O3)cc2cn1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.37
LPL P06858 6/20 0.33
LIPG Q9Y5X9 6/20 0.33
DGAT1 O75907 1/20 0.32
PDGFRB P09619 1/20 0.32
KDR P35968 1/20 0.32
AAK1 Q2M2I8 1/20 0.32
F11 P03951 1/20 0.31
GSK3A P49840 1/20 0.30
GSK3B P49841 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
SCHEMBL25151086 0.74 IRAK4 (0.36) FFAR1IRAK4LPLLIPGF11
SCHEMBL15176276 0.74 IRAK4 (0.41) FFAR1IRAK4LPLLIPGF11
SCHEMBL2959083 0.74 FFAR1 (0.40) FFAR1IRAK4LPLLIPGDGAT1
SCHEMBL15175675 0.72 LPL (0.36) FFAR1IRAK4LPLLIPG
SCHEMBL25295739 0.72 IRAK4 (0.35) FFAR1IRAK4LPLLIPG
SCHEMBL24718096 0.70 L3MBTL1 (0.50) FFAR1IRAK4LPLLIPGF11
SCHEMBL42112 0.69 LPL (0.47) IRAK4LPLLIPGDGAT1
SCHEMBL25150881 0.69 IRAK4 (0.33) FFAR1IRAK4LPLLIPG
SCHEMBL25202785 0.69 FFAR1 (0.34) FFAR1IRAK4LPLLIPGPDGFRB
SCHEMBL15176393 0.69 FFAR1 (0.36) FFAR1IRAK4LPLLIPGF11

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
US-20220287748-A1 PROPHYLACTIC OR THERAPEUTIC AGENT FOR SPINAL MUSCULAR ATROPHY REBORNA BIOSCIENCES, INC. (JP) 2022-09-15 US disclosed
EP-3816160-A1 PROPHYLACTIC OR THERAPEUTIC AGENT FOR SPINAL MUSCULAR ATROPHY Reborna Biosciences, Inc. (JP) 2021-05-05 EP disclosed