SCHEMBL5584845

SCHEMBL5584845

O=C1CCCN1Cc1ccccc1OC[C@@H]1CO1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
GLA P06280 1/20 0.47
ACHE P22303 3/20 0.46
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ADRA1D P25100 2/20 0.41
ADRA1A P35348 2/20 0.41
TDP1 Q9NUW8 1/20 0.40
RAB9A P51151 1/20 0.39
KCNH2 Q12809 1/20 0.38

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
SCHEMBL5584847 1.00 ALDH1A1 (0.47) ALDH1A1GLAACHEKMT2AMEN1
SCHEMBL7484195 0.77 ACHE (0.68) ACHEKMT2AMEN1L3MBTL1ADRA1D
SCHEMBL5584701 0.76 ALDH1A1 (0.54) ALDH1A1KMT2AL3MBTL1TDP1
SCHEMBL5584698 0.76 ALDH1A1 (0.54) ALDH1A1KMT2AL3MBTL1TDP1
SCHEMBL29618932 0.73 ALDH1A1 (0.67) ALDH1A1GLAKMT2AMEN1L3MBTL1
SCHEMBL3412321 0.73 ALDH1A1 (0.62) ALDH1A1GLAKMT2AMEN1ADRA1A
SCHEMBL4276592 0.73 ALDH1A1 (0.67) ALDH1A1GLAKMT2AMEN1L3MBTL1
SCHEMBL1745602 0.73 ALDH1A1 (0.66) ALDH1A1GLAKMT2AMEN1ADRA1A
SCHEMBL4513254 0.72 KMT2A (0.64) ACHEKMT2AMEN1MAPK1L3MBTL1
SCHEMBL14537170 0.72 MAPK1 (0.56) ALDH1A1ACHEKMT2AMAPK1L3MBTL1

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-7196199-B2 Antiserotonine agents; antidepressants MITSUBISHI PHARMA CORPORATION (JP) 2007-03-27 US disclosed
US-20040138227-A1 Phenoxypropylamine compounds NISHIYAMA AKIRA 2004-07-15 US disclosed
US-6720320-B2 ANTISEROTONINE AGENTS MITSUBISHI PHARMA CORPORATION (JP) 2004-04-13 US disclosed
US-20020111358-A1 Phenoxypropylamine compounds MITSUBISHI PHARMA CORPORATION (JP) 2002-08-15 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 (2 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-20040138227-A1 Phenoxypropylamine compounds HTR1A, HTR1D, HTR5A ALDH1A1 443/4885GLA 3730/4885ACHE 714/4885
US-20020111358-A1 Phenoxypropylamine compounds HTR1A, HTR1D, HTR5A ALDH1A1 443/4885GLA 3730/4885ACHE 714/4885

“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.