SCHEMBL6320185

SCHEMBL6320185

[CH2]N(C)CC(O)c1ccc(CO)cc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 7/20 0.46
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CNR2 P34972 1/20 0.39
TAAR1 Q96RJ0 1/20 0.37
ADRB2 P07550 1/20 0.37
TSHR P16473 1/20 0.37
LMNA P02545 1/20 0.35
ALDH1A1 P00352 2/20 0.35
LTA4H P09960 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 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
SCHEMBL6320187 0.85 AOC3 (0.46) AOC3KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL6318407 0.84 KDM4E (0.49) AOC3KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL6320570 0.81 TAAR1 (0.50) AOC3KDM4ESMN1; SMN2TAAR1TSHR
SCHEMBL6284970 0.80 AOC3 (0.68) AOC3KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL6281298 0.79 AOC3 (0.68) AOC3KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL6281260 0.79 AOC3 (0.68) AOC3KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL6320706 0.77 KDM4E (0.54) AOC3KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL6479386 0.76 AOC3 (0.70) AOC3ALDH1A1
SCHEMBL6281184 0.76 AOC3 (0.47) AOC3KDM4ELMNA
SCHEMBL6317815 0.75 AOC3 (0.46) AOC3MEN1KMT2ASMN1; SMN2ADRB2

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-6852731-B2 Antiviral compounds PFIZER (US) 2005-02-08 US claimed
US-20040242884-A1 ANTIVIRAL COMPOUNDS PHARMACIA & UPJOHN COMPANY 2004-12-02 US claimed
EP-1472260-A2 THIENO(3,2-B)PYRIDONES AS ANTIVIRAL COMPOUNDS PHARMACIA & UPJOHN COMPANY (US) 2004-11-03 EP claimed
WO-2003059878-A2 THIENO (3, 2-B) PYRIDONES AS ANTIVIRAL COMPOUNDS PHARMACIA & UPJOHN COMPANY (US) 2003-07-24 WO claimed

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-20040242884-A1 ANTIVIRAL COMPOUNDS ZC3HAV1, IRF3, IFNAR1 AOC3 4410/4885KDM4E 1156/4885MEN1 1462/4885

“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.