SCHEMBL4282905

SCHEMBL4282905

O=C(Cc1ccccc1)c1ccccc1.[Na]

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.70
L3MBTL1 Q9Y468 3/20 0.70
SRD5A2 P31213 2/20 0.68
TDP1 Q9NUW8 3/20 0.58
CES1 P23141 2/20 0.58
MAPK1 P28482 2/20 0.58
CES2 O00748 1/20 0.58
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.58
CYP3A4 P08684 1/20 0.58
HPGD P15428 1/20 0.58
ALOX15 P16050 1/20 0.58
KMT2A Q03164 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
AKR1B1 P15121 1/20 0.58
PLAU P00749 2/20 0.58
STS P08842 1/20 0.56
RAB9A P51151 2/20 0.55
NPC1 O15118 1/20 0.55
CASP3 P42574 1/20 0.55

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
SCHEMBL24800 0.98 MAPT (0.73) MAPTL3MBTL1SRD5A2TDP1CES1
Water SCHEMBL9243001 0.95 MAPT (0.70) MAPTL3MBTL1SRD5A2TDP1CES1
Hydrochloric Acid SCHEMBL27315608 0.95 MAPT (0.70) MAPTL3MBTL1SRD5A2TDP1CES1
Water SCHEMBL20527670 0.95 MAPT (0.70) MAPTL3MBTL1SRD5A2TDP1CES1
Bicarbonate SCHEMBL28984888 0.95 MAPT (0.70) MAPTL3MBTL1SRD5A2TDP1CES1
Formaldehyde SCHEMBL27372987 0.93 MAPT (0.68) MAPTL3MBTL1SRD5A2TDP1CES1
Methyl Alcohol SCHEMBL11602292 0.93 MAPT (0.68) MAPTL3MBTL1SRD5A2TDP1CES1
SCHEMBL7129800 0.93 MAPT (0.80) MAPTL3MBTL1SRD5A2TDP1CES1
SCHEMBL7199268 0.93 MAPT (0.67) MAPTL3MBTL1SRD5A2TDP1CES1
Benzil SCHEMBL11207166 0.91 MAPT (0.66) MAPTL3MBTL1SRD5A2TDP1CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7622540-B2 Metal carbonate initiator and method for polymerizing isocyanates using the same GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-11-24 US disclosed
EP-1882710-B1 Use of metal enolate initiators for polymerizing isocyanates KWANGJU INST SCI & TECH (KR) 2009-11-18 EP disclosed
US-20080027204-A1 Metal carbonate initiator and method for polymerizing isocyanates using the same GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-01-31 US disclosed
EP-1882710-A1 Metal carbonate initiator and method for polymerizing isocyanates using the same Gwangju Institute of Science and Technology (GIST) (KR) 2008-01-30 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080027204-A1 Metal carbonate initiator and method for polymerizing isocyanates using the same CA2, CA1, CA3 MAPT 731/4885L3MBTL1 4452/4885SRD5A2 3130/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.