SCHEMBL25833591

SCHEMBL25833591

CC(=O)Cc1cccc(OP(=O)(O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.49
IDUA P35475 1/20 0.46
PLK1 P53350 1/20 0.43
INPPL1 O15357 2/20 0.42
INPP5A Q14642 2/20 0.42
CTBP2 P56545 1/20 0.42
F10 P00742 1/20 0.41
CETP P11597 1/20 0.39
MMP13 P45452 1/20 0.39
BLM P54132 1/20 0.39
POLB P06746 1/20 0.39
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
GGPS1 O95749 1/20 0.38

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
SCHEMBL23671710 0.85 SRC (0.53) SRCIDUAPLK1INPPL1INPP5A
SCHEMBL23692350 0.83 SRC (0.45) SRCIDUAPLK1INPPL1INPP5A
SCHEMBL12344129 0.81 SRC (0.53) SRCPLK1INPPL1INPP5ABLM
SCHEMBL269177 0.80 CTBP2 (0.62) CTBP2MMP13POLBMTNR1AMTNR1B
SCHEMBL28884101 0.80 SRC (0.54) SRCIDUAPLK1INPPL1INPP5A
SCHEMBL4336266 0.80 SRC (0.54) SRCIDUAPLK1INPPL1INPP5A
SCHEMBL2091042 0.78 CTBP2 (0.45) CTBP2F10MMP13POLBMTNR1A
SCHEMBL694402 0.78 CYP3A4 (0.58) CTBP2F10POLBLMNA
SCHEMBL9162999 0.78 SRC (0.53) SRCIDUAPLK1INPPL1INPP5A
SCHEMBL27826220 0.78 SRC (0.53) SRCIDUAPLK1INPPL1INPP5A

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
EP-4209483-A1 PRODRUG MODULATORS OF THE INTEGRATED STRESS PATHWAY Calico Life Sciences LLC (US) 2023-07-12 EP disclosed