Benzoic Acid 2,3-Epoxypropyl Ester

Benzoic Acid 2,3-Epoxypropyl Ester

SCHEMBL283022

CCOCC.O=C(OCC1CO1)c1ccccc1

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.52
CHRNB2 P17787 1/20 0.50
CHRNA5 P30532 1/20 0.50
CHRNA7 P36544 1/20 0.50
CHRNA4 P43681 1/20 0.50
LMNA P02545 1/20 0.49
MGLL Q99685 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
GAA P10253 1/20 0.47
RAB9A P51151 1/20 0.47
TSHR P16473 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
Ether SCHEMBL3122176 0.92 CA12 (0.46) NPC1CHRNB2CHRNA5CHRNA7CHRNA4
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL133986 0.91 NPC1 (0.56) NPC1CHRNB2CHRNA5CHRNA7CHRNA4
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL21245419 0.91 NPC1 (0.56) NPC1CHRNB2CHRNA5CHRNA7CHRNA4
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL14570069 0.91 NPC1 (0.56) NPC1CHRNB2CHRNA5CHRNA7CHRNA4
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL5604855 0.91 NPC1 (0.56) NPC1CHRNB2CHRNA5CHRNA7CHRNA4
Ether SCHEMBL3123379 0.90 ALDH1A1 (0.45) NPC1CHRNB2CHRNA4SMN1; SMN2RAB9A
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL28184062 0.89 NPC1 (0.52) NPC1CHRNB2CHRNA5CHRNA7CHRNA4
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL6359889 0.89 NPC1 (0.55) NPC1CHRNB2CHRNA5CHRNA7CHRNA4
Ethyl Benzoate SCHEMBL11834545 0.88 SMN1; SMN2 (0.54) NPC1CHRNB2CHRNA5CHRNA7CHRNA4
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL6358027 0.88 CHRNB2 (0.55) NPC1CHRNB2CHRNA5CHRNA7CHRNA4

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
CN-113423794-A Curable composition 株式会社钟化 2021-09-21 CN disclosed
WO-2012036546-A1 CURABLE LIQUID RESIN COMPOSITION FOR OUTERMOST COVERING LAYERS OF OPTICAL FIBER LINE DSM IP ASSETS B.V. (NL) 2012-03-22 WO disclosed
EP-2428498-A1 Curable liquid resin composition for outermost covering layers of optical fiber line DSM IP Assets B.V. (NL) 2012-03-14 EP disclosed