SCHEMBL11360950

SCHEMBL11360950

Cc1ccc(OP(=O)(O)O)c(Br)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 7/20 0.48
INPP5A Q14642 4/20 0.48
AKT1 P31749 1/20 0.48
INPP5B P32019 2/20 0.48
SMN1; SMN2 Q16637 4/20 0.44
KDM4E B2RXH2 3/20 0.43
USP2 O75604 1/20 0.43
TDP1 Q9NUW8 3/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
NPC1 O15118 2/20 0.42
HPGD P15428 2/20 0.42
RAB9A P51151 2/20 0.42
GAA P10253 1/20 0.42
TSHR P16473 1/20 0.42
ABL1 P00519 1/20 0.42
RIN1 Q13671 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
ALDH1A1 P00352 2/20 0.42

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
SCHEMBL1661140 0.85 TSHR (0.47) SMN1; SMN2KDM4EUSP2TDP1CYP1A2
Triclofos SCHEMBL11673995 0.84 SMN1; SMN2 (0.38) INPPL1INPP5AAKT1SMN1; SMN2KDM4E
SCHEMBL4370189 0.81 MAPK1 (0.54) INPPL1INPP5AAKT1INPP5BSMN1; SMN2
SCHEMBL109597 0.81 INPPL1 (0.52) INPPL1INPP5AAKT1INPP5BTDP1
SCHEMBL27746698 0.79 MAPK1 (0.52) INPPL1INPP5AAKT1INPP5BSMN1; SMN2
SCHEMBL27559347 0.79 INPPL1 (0.50) INPPL1INPP5AAKT1INPP5BTDP1
SCHEMBL28656347 0.79 INPPL1 (0.50) INPPL1INPP5AAKT1INPP5BTDP1
Triaziquone SCHEMBL6309695 0.78 SMN1; SMN2 (0.37) INPPL1INPP5AAKT1SMN1; SMN2KDM4E
SCHEMBL14403284 0.78 ACHE (0.61) INPPL1INPP5AAKT1INPP5BSMN1; SMN2
SCHEMBL7591862 0.78 INPPL1 (0.48) INPPL1INPP5AAKT1INPP5BKDM4E

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
US-4255318-A COMPRISING A CURABLE POLYCHLOROPRENE, A METAL HYDROXIDE, AND A HEAT-RESISTANT FIBER; CONSTRUCTION MATERIALS DAINICHI-NIPPON CABLES, LTD. (JP) 1981-03-10 US disclosed