SCHEMBL11547246

SCHEMBL11547246

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

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.43
PTPN1 P18031 3/20 0.37
CETP P11597 3/20 0.35
NAAA Q02083 1/20 0.35
KIF11 P52732 1/20 0.34
CES2 O00748 2/20 0.34
SRC P12931 1/20 0.34
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
PRSS1 P07477 1/20 0.33
CTSG P08311 1/20 0.33
CTRB1 P17538 1/20 0.33
CMA1 P23946 1/20 0.33

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
SCHEMBL9346018 0.88 CES1 (0.47) CES1PTPN1SRCLMNAPOLB
SCHEMBL11544882 0.80 PTPN1 (0.36) CES1PTPN1CETPNAAACES2
SCHEMBL11544295 0.80 CES1 (0.49) CES1PTPN1SRCTDP1L3MBTL1
SCHEMBL11546671 0.80 CES1 (0.53) CES1PTPN1SRCTDP1LMNA
SCHEMBL11543996 0.77 CES1 (0.46) CES1PTPN1KIF11SRCTDP1
SCHEMBL9342068 0.77 CES1 (0.39) CES1PTPN1SRCKMT2ALMNA
SCHEMBL11588453 0.76 CES1 (0.40) CES1PTPN1SRCTDP1LMNA
SCHEMBL11540703 0.75 CES1 (0.38) CES1PTPN1SRCLMNAPOLB
SCHEMBL11543056 0.75 CES1 (0.38) CES1PTPN1SRCKMT2ATDP1
SCHEMBL11548159 0.75 CES1 (0.47) CES1PTPN1CETPNAAAKIF11

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