SCHEMBL8208400

SCHEMBL8208400

O=C(O)c1cccc(OCC2CO2)c1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.68
TP53 P04637 1/20 0.68
CYP3A4 P08684 1/20 0.68
TSHR P16473 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
HIF1A Q16665 1/20 0.68
TDP1 Q9NUW8 1/20 0.60
NR1H4 Q96RI1 5/20 0.57
NR4A2 P43354 7/20 0.55
KMT2A Q03164 1/20 0.55
AKR1C3 P42330 1/20 0.50
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49

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
SCHEMBL19827992 0.88 ALDH1A1 (0.68) ALDH1A1TP53CYP3A4TSHRSMN1; SMN2
SCHEMBL6915699 0.87 SMN1; SMN2 (0.66) ALDH1A1TP53CYP3A4TSHRSMN1; SMN2
SCHEMBL6915692 0.87 SMN1; SMN2 (0.66) ALDH1A1TP53CYP3A4TSHRSMN1; SMN2
SCHEMBL9448356 0.87 ALDH1A1 (0.66) ALDH1A1TP53CYP3A4TSHRSMN1; SMN2
SCHEMBL19827996 0.87 ALDH1A1 (0.66) ALDH1A1TP53CYP3A4TSHRSMN1; SMN2
SCHEMBL6915703 0.87 SMN1; SMN2 (0.66) ALDH1A1TP53CYP3A4TSHRSMN1; SMN2
SCHEMBL11198075 0.85 ALDH1A1 (0.64) ALDH1A1TP53CYP3A4TSHRSMN1; SMN2
SCHEMBL32684970 0.84 SMN1; SMN2 (0.62) ALDH1A1TP53CYP3A4TSHRSMN1; SMN2
SCHEMBL2449187 0.84 ALDH1A1 (0.53) ALDH1A1TP53CYP3A4TSHRSMN1; SMN2
SCHEMBL4429220 0.83 ALDH1A1 (0.65) ALDH1A1TP53CYP3A4TSHRSMN1; SMN2

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115353326-A Reflective anti-vehicle-mark asphalt and preparation method thereof 魏玉芝 2022-11-18 CN claimed
JP-9100458-A None JP disclosed
CN-115353326-A Reflective anti-vehicle-mark asphalt and preparation method thereof 魏玉芝 2022-11-18 CN disclosed
CN-115353326-A Reflective anti-vehicle-mark asphalt and preparation method thereof 魏玉芝 2022-11-18 CN disclosed
EP-0747371-B1 Epoxy resins consisting of flexible chains terminated with glycidyloxyphenyl groups for use in microelectronics adhesives NAT STARCH CHEM INVEST (US) 2000-09-06 EP disclosed
EP-0996439-A1 $g(b)-ALKOXYACRYLATES AGAINST MALARIA F. HOFFMANN-LA ROCHE AG (CH) 2000-05-03 EP disclosed
WO-1999002150-A1 β-ALKOXYACRYLATES AGAINST MALARIA F. HOFFMANN-LA ROCHE AG (CH) 1999-01-21 WO disclosed
US-5717054-A QUICK-SETTING NATIONAL STARCH & CHEMICAL INVESTMENT HOLDING CORP. (US) 1998-02-10 US disclosed
JP-H09100458-A EPOXY RESIN HAVING FLEXIBLE CHAINS TERMINATED WITH GLYCIDYLOXYPHENYL GROUP TO BE USED IN MICROELECTRONIC ADHESION NATL STARCH & CHEM INVESTMENT HOLDING CORP 1997-04-15 JP disclosed
EP-0747371-A1 Epoxy resins consisting of flexible chains terminated with glycidyloxyphenyl groups for use in microelectronics adhesives National Starch and Chemical Investment Holding Corporation (US) 1996-12-11 EP disclosed
EP-0547126-A1 POLYMERS CONTAINING DIESTER UNITS. NYCOMED IMAGING AS (NO) 1993-06-23 EP disclosed
WO-1992004392-A1 POLYMERS CONTAINING DIESTER UNITS HOLMES, MICHAEL, JOHN (GB) 1992-03-19 WO disclosed