Benzoyl Formic Acid

Benzoyl Formic Acid

SCHEMBL6550783

CC(=O)C(C)=O.O=C(O)C(=O)c1ccccc1

nearest known ligand 0.73

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 12/20 0.73
CES1 P23141 11/20 0.73
CPT1B Q92523 1/20 0.52
MAPT P10636 2/20 0.48
RAB9A P51151 2/20 0.48
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
GLA P06280 1/20 0.48
KMT2A Q03164 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
LMNA P02545 1/20 0.48
XBP1 P17861 1/20 0.48
ATM Q13315 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
DAO P14920 1/20 0.48
TSHR P16473 1/20 0.48
NAPRT Q6XQN6 1/20 0.48

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
Benzil SCHEMBL1481339 0.90 CES2 (0.80) CES2CES1MAPTRAB9AALDH1A1
Benzoyl Formic Acid SCHEMBL15180886 0.89 CES2 (0.77) CES2CES1CPT1BMAPTRAB9A
Benzoyl Formic Acid SCHEMBL15180811 0.89 CES2 (0.77) CES2CES1CPT1BMAPTRAB9A
Benzoyl Formic Acid SCHEMBL15180809 0.89 CES2 (0.77) CES2CES1CPT1BMAPTRAB9A
Benzoyl Formic Acid SCHEMBL15180800 0.89 CES2 (0.77) CES2CES1CPT1BMAPTRAB9A
Benzoyl Formic Acid SCHEMBL15180795 0.89 CES2 (0.77) CES2CES1CPT1BMAPTRAB9A
Benzoyl Formic Acid SCHEMBL15180817 0.89 CES2 (0.77) CES2CES1CPT1BMAPTRAB9A
Benzoyl Formic Acid SCHEMBL38943 0.89 CES2 (0.77) CES2CES1CPT1BMAPTRAB9A
Benzoyl Formic Acid SCHEMBL15180815 0.89 CES2 (0.77) CES2CES1CPT1BMAPTRAB9A
Benzoyl Formic Acid SCHEMBL8919349 0.89 CES2 (0.77) CES2CES1CPT1BMAPTRAB9A

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-1209492-B1 Formation of materials such as waveguides with a refractive index step NAT UNIV IRELAND CORK (IE) 2004-02-04 EP disclosed
US-20020142096-A1 Induction gelation; optic diffraction; three-dimensional crosslinking CONNELL ANDREW (IE) 2002-10-03 US disclosed
EP-1209492-A1 Formation of materials such as waveguides with a refractive index step National University of Ireland Cork (IE) 2002-05-29 EP disclosed