SCHEMBL7100035

SCHEMBL7100035

CCCCCCCCCCCCCCC(C(=O)O)C(CCCCCCCCCCCCCC)(C(=O)O)S(=O)(=O)O.[NaH]

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSPD1 P10809 1/20 0.49
BLM P54132 1/20 0.49
HSPE1 P61604 1/20 0.49
MEN1 O00255 1/20 0.45
HPGD P15428 1/20 0.45
RECQL P46063 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GPR84 Q9NQS5 7/20 0.41
FFAR1 O14842 1/20 0.41
MAPT P10636 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
ACE2 Q9BYF1 1/20 0.38
TP53 P04637 1/20 0.37

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
SCHEMBL223463 1.00 HSPD1 (0.49) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL7098227 1.00 HSPD1 (0.49) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL1250929 1.00 HSPD1 (0.49) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL472822 1.00 HSPD1 (0.49) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL7790020 1.00 HSPD1 (0.49) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL15521 1.00 HSPD1 (0.49) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL7207859 1.00 HSPD1 (0.49) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL7100620 1.00 HSPD1 (0.49) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL7096167 1.00 HSPD1 (0.49) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL28992444 1.00 HSPD1 (0.49) HSPD1BLMHSPE1MEN1HPGD

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-0964036-B1 Water-based ball-point pen ink composition PILOT INK CO LTD (JP) 2003-08-27 EP disclosed
US-6261352-B1 BETAINE, SULFO ESTER THE PILOT INK CO., LTD. (JP) 2001-07-17 US disclosed
EP-0964036-A2 Water-based ball-point pen ink composition THE PILOT INK CO., LTD. (JP) 1999-12-15 EP disclosed
US-4965328-A Preparation of paste forming vinyl chloride polymers with high pressure homogenization HUELS AKTIENGESELLSCHAFT (DE) 1990-10-23 US disclosed