SCHEMBL11544882

SCHEMBL11544882

CCCCOC(C(=O)c1ccccc1)(c1ccccc1)C(CC)(CC)CP(=O)(O)O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.36
CES1 P23141 2/20 0.36
CETP P11597 3/20 0.34
LMNA P02545 1/20 0.34
NAAA Q02083 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
CES2 O00748 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HIF1A Q16665 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
SCHEMBL11588453 0.89 CES1 (0.40) PTPN1CES1LMNATSHRTDP1
SCHEMBL11542276 0.88 CES1 (0.36) PTPN1CES1LMNATSHR
SCHEMBL9342068 0.88 CES1 (0.39) PTPN1CES1LMNAMEN1KMT2A
SCHEMBL9346018 0.84 CES1 (0.47) PTPN1CES1LMNATSHR
SCHEMBL11543056 0.81 CES1 (0.38) PTPN1CES1LMNAMEN1RAB9A
SCHEMBL11540703 0.81 CES1 (0.38) PTPN1CES1LMNATSHR
SCHEMBL11547246 0.80 CES1 (0.43) PTPN1CES1CETPLMNANAAA
SCHEMBL11541968 0.75 PRSS1 (0.34) PTPN1CES1CETPCES2MEN1
SCHEMBL11171387 0.73 CES1 (0.58) CES1LMNANAAAL3MBTL1CES2
SCHEMBL2819529 0.72 CES1 (0.45) CES1LMNANAAAL3MBTL1CES2

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