SCHEMBL8501897

SCHEMBL8501897

CCC(c1cc(C)c(OS(=O)(=O)c2ccccc2)c(C)c1)c1cc(C)c(OS(=O)(=O)c2ccccc2)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.43
TDP1 Q9NUW8 5/20 0.42
GAA P10253 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 3/20 0.42
KMT2A Q03164 1/20 0.42
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
ALDH1A1 P00352 4/20 0.39
LMNA P02545 1/20 0.39
P2RX7 Q99572 1/20 0.39
PSIP1 O75475 1/20 0.38
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TUBB4A P04350 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38
TUBA1B P68363 1/20 0.38
TUBA4A P68366 1/20 0.38
TUBB4B P68371 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
SCHEMBL19912237 0.84 ALPL (0.45) ALPLTDP1GAASMN1; SMN2MAPT
SCHEMBL19917486 0.81 NPC1 (0.45) ALPLTDP1GAASMN1; SMN2MAPT
SCHEMBL28115946 0.80 FFAR4 (0.51) ALPLTDP1SMN1; SMN2MAPTNPC1
SCHEMBL3843547 0.80 ALPL (0.46) ALPLTDP1GAASMN1; SMN2MAPT
SCHEMBL28229836 0.78 ALPL (0.47) ALPLTDP1SMN1; SMN2MAPTNPC1
SCHEMBL1286018 0.77 ALPL (0.48) ALPLTDP1SMN1; SMN2MAPTNPC1
SCHEMBL3838606 0.76 ALPL (0.46) ALPLTDP1SMN1; SMN2MAPTNPC1
SCHEMBL8501868 0.76 TDP1 (0.57) TDP1GAASMN1; SMN2MAPTKMT2A
SCHEMBL7521769 0.76 ALPL (0.39) ALPLTDP1GAASMN1; SMN2MAPT
SCHEMBL1826030 0.75 TDP1 (0.56) TDP1GAASMN1; SMN2MAPTKMT2A

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
EP-0956312-A1 PROCESS FOR PRODUCING PHENYLENE-CONTAINING POLYMER AND FILM-FORMING MATERIAL JSR Corporation (JP) 1999-11-17 EP disclosed
WO-1998033836-A1 PROCESS FOR PRODUCING PHENYLENE-CONTAINING POLYMER AND FILM-FORMING MATERIAL JSR CORPORATION (JP) 1998-08-06 WO disclosed