SCHEMBL5416769

SCHEMBL5416769

C=C(CCCc1ccc2cccc3c4cccc5cccc(c1c23)c54)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
CYP1A2 P05177 5/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP2D6 P10635 2/20 0.40
KDM4E B2RXH2 2/20 0.40
GLA P06280 1/20 0.40
POLB P06746 1/20 0.40
THRB P10828 1/20 0.37
CYP2C19 P33261 1/20 0.37
MTNR1A P48039 2/20 0.35
MCL1 Q07820 3/20 0.34
TDP1 Q9NUW8 1/20 0.33
MTNR1B P49286 1/20 0.33
FFAR1 O14842 1/20 0.33
AKR1B1 P15121 1/20 0.33
PPARG P37231 1/20 0.32

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
SCHEMBL2806261 0.85 KMT2A (0.72) KMT2AMEN1CYP1A2ALDH1A1HPGD
SCHEMBL2955108 0.82 KMT2A (0.67) KMT2AMEN1CYP1A2ALDH1A1HPGD
SCHEMBL4634463 0.82 KMT2A (0.67) KMT2AMEN1CYP1A2ALDH1A1HPGD
SCHEMBL3257808 0.82 KMT2A (0.67) KMT2AMEN1CYP1A2ALDH1A1HPGD
SCHEMBL7560914 0.80 TDP1 (0.51) KMT2AMEN1CYP1A2CYP2D6KDM4E
SCHEMBL1497444 0.78 KMT2A (0.66) KMT2AMEN1CYP1A2ALDH1A1HPGD
SCHEMBL28651005 0.77 ALDH1A1 (0.45) KMT2AMEN1CYP1A2ALDH1A1HPGD
SCHEMBL537192 0.74 CYP1A2 (0.45) KMT2AMEN1CYP1A2ALDH1A1HPGD
SCHEMBL28055564 0.74 TDP1 (0.56) KMT2AMEN1CYP1A2ALDH1A1HPGD
SCHEMBL4629857 0.74 ALDH1A1 (0.45) KMT2AMEN1CYP1A2ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7160634-B2 Vinyl polymer and organic electroluminescent device Shirota, Yasuhiko (JP) 2007-01-09 US disclosed
US-20060049750-A1 Vinyl polymer and organic electroluminescent device SHIROTA YASUHIKO 2006-03-09 US 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-20060049750-A1 Vinyl polymer and organic electroluminescent device HVCN1, VCL, ELAVL1 KMT2A 922/4885MEN1 4130/4885CYP1A2 1678/4885

“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.