SCHEMBL6936775

SCHEMBL6936775

O=C(OC(COc1ccccc1)COc1ccc(Oc2ccccc2)cc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
MEN1 O00255 1/20 0.52
LMNA P02545 1/20 0.52
ALOX12 P18054 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 3/20 0.51
GAA P10253 1/20 0.51
CYP19A1 P11511 1/20 0.51
MAPK1 P28482 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.48
LTA4H P09960 1/20 0.47
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
TP53 P04637 1/20 0.46
PARP10 Q53GL7 1/20 0.45
SRD5A2 P31213 2/20 0.44
PGR P06401 1/20 0.44
PKM P14618 1/20 0.44
AKR1C3 P42330 1/20 0.44

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
SCHEMBL6881909 0.88 ALDH1A1 (0.56) TSHRMEN1LMNAALOX12KMT2A
SCHEMBL11957637 0.88 LMNA (0.50) TSHRMEN1LMNAALOX12KMT2A
SCHEMBL11957653 0.87 MAPT (0.54) TSHRMEN1LMNAALOX12KMT2A
SCHEMBL13809706 0.86 SMN1; SMN2 (0.57) TSHRALDH1A1SMN1; SMN2RAB9ATP53
SCHEMBL13809716 0.86 SMN1; SMN2 (0.57) TSHRALDH1A1SMN1; SMN2RAB9ATP53
SCHEMBL13809721 0.84 SMN1; SMN2 (0.59) MEN1KMT2AALDH1A1SMN1; SMN2PARP10
SCHEMBL15385987 0.84 KMT2A (0.55) TSHRMEN1LMNAALOX12KMT2A
SCHEMBL6880910 0.83 MAPT (0.56) TSHRMEN1LMNAALOX12KMT2A
SCHEMBL15385967 0.82 MEN1 (0.51) TSHRMEN1LMNAALOX12KMT2A
SCHEMBL6879080 0.81 ALDH1A1 (0.51) TSHRMEN1LMNAALOX12KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0972776-B1 A phosphine sulfide, a manufacturing process therefor and a use thereof MITSUI CHEMICALS INC (JP) 2003-04-23 EP disclosed
US-6153794-A Phosphine sulfide, a manufacturing process therefor and use thereof MITSUI CHEMICALS, INC. (JP) 2000-11-28 US disclosed
CN-1262276-A Phosphine sulfide preparing process and use thereof MITSUI CHEMICALS INC (JP) 2000-08-09 CN disclosed
EP-0972776-A1 A phosphine sulfide, a manufacturing process therefor and a use thereof Mitsui Chemicals, Inc. (JP) 2000-01-19 EP disclosed