SCHEMBL11548159

SCHEMBL11548159

CCCCC(CCCC)(CP(=O)(O)O)OC(OC(CCCC)(CCCC)CP(=O)(O)O)(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.47
PTPN1 P18031 3/20 0.38
CETP P11597 3/20 0.36
NAAA Q02083 1/20 0.35
KIF11 P52732 1/20 0.35
CES2 O00748 2/20 0.35
TSHR P16473 1/20 0.34
PRSS1 P07477 2/20 0.34
CTSG P08311 2/20 0.34
CTRB1 P17538 2/20 0.34
CMA1 P23946 2/20 0.34

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
SCHEMBL11540824 0.87 CES1 (0.51) CES1PTPN1TSHR
SCHEMBL11545782 0.80 CES1 (0.49) CES1PTPN1CETPTSHR
SCHEMBL11544661 0.79 CES1 (0.54) CES1PTPN1TSHRPRSS1CTSG
SCHEMBL11547246 0.75 CES1 (0.43) CES1PTPN1CETPNAAAKIF11
SCHEMBL11549447 0.74 CES1 (0.41) CES1PTPN1KIF11TSHR
SCHEMBL11543720 0.73 CES1 (0.40) CES1PTPN1TSHRPRSS1CTSG
SCHEMBL11547495 0.73 CES1 (0.40) CES1PTPN1CES2TSHR
SCHEMBL11541059 0.73 ALDH1A1 (0.45) PTPN1CETPTSHRPRSS1CTSG
SCHEMBL11171387 0.72 CES1 (0.58) CES1NAAACES2TSHR
SCHEMBL1260547 0.72 CES1 (0.46) CES1NAAAKIF11CES2PRSS1

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
US-4160794-A CURING OR POLYMERIZATION PHOTOINITIATORS CIBA-GEIGY CORPORATION (US) 1979-07-10 US disclosed
US-4082821-A PHOTOINITIATORS CIBA-GEIGY CORPORATION (US) 1978-04-04 US disclosed