SCHEMBL9440386

SCHEMBL9440386

COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)O[PH](Cc2ccccc2)(Cc2ccccc2)Cc2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.46
LMNA P02545 1/20 0.46
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 3/20 0.43
TSHR P16473 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
HIF1A Q16665 1/20 0.41
GAA P10253 2/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
PKM P14618 1/20 0.40
POLB P06746 2/20 0.40
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
PTGS2 P35354 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MGLL Q99685 1/20 0.39

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
SCHEMBL9440880 0.86 LCK (0.42) LMNAALDH1A1TSHRGAAMEN1
SCHEMBL10484404 0.82 POLB (0.43) HPGDLMNANPC1RAB9AALDH1A1
SCHEMBL9440399 0.80 KDM4E (0.42) HPGDLMNAALDH1A1KDM4ETSHR
SCHEMBL9440613 0.80 TSHR (0.46) HPGDLMNARAB9AALDH1A1KDM4E
SCHEMBL9440934 0.78 KDM4E (0.40) HPGDLMNAALDH1A1KDM4ETSHR
SCHEMBL6555898 0.77 HPGD (0.44) HPGDLMNANPC1RAB9AALDH1A1
SCHEMBL3915615 0.77 TSHR (0.46) HPGDLMNANPC1RAB9AALDH1A1
SCHEMBL6555906 0.76 HPGD (0.43) HPGDLMNANPC1RAB9AALDH1A1
SCHEMBL9440620 0.76 KDM4E (0.38) HPGDLMNANPC1RAB9AALDH1A1
SCHEMBL11694853 0.75 ALDH1A1 (0.51) HPGDLMNARAB9AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0280026-B1 Copolyester fiber TEIJIN LTD (JP) 1994-03-30 EP disclosed
US-4851504-A Cationically-dyeable, thermally-resistant copolyester fiber comprising quaternary phosphonium organic sulfonate groups TEIJIN LIMITED (JP) 1989-07-25 US disclosed
EP-0280026-A2 Copolyester fiber TEIJIN LIMITED (JP) 1988-08-31 EP disclosed