SCHEMBL6043540

SCHEMBL6043540

COCCCOc1ccccc1CN

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.50
HPGD P15428 2/20 0.50
MAPT P10636 2/20 0.50
ATM Q13315 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.45
NPSR1 Q6W5P4 1/20 0.44
KDM4E B2RXH2 3/20 0.44
TAAR1 Q96RJ0 1/20 0.43
HRH1 P35367 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 1/20 0.42
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 1/20 0.41
PPARD Q03181 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL6043757 0.96 KDM4E (0.47) L3MBTL1HPGDMAPTATMSMN1; SMN2
SCHEMBL6043399 0.95 KDM4E (0.46) L3MBTL1HPGDMAPTATMSMN1; SMN2
SCHEMBL10736684 0.91 L3MBTL1 (0.50) L3MBTL1HPGDMAPTATMSMN1; SMN2
SCHEMBL12408539 0.90 KDM4E (0.52) L3MBTL1HPGDMAPTATMSMN1; SMN2
Hydrochloric Acid SCHEMBL1848634 0.89 L3MBTL1 (0.49) L3MBTL1HPGDMAPTATMSMN1; SMN2
SCHEMBL27449242 0.86 TAAR1 (0.62) L3MBTL1HPGDMAPTATMSMN1; SMN2
SCHEMBL2903622 0.83 CYP1A2 (0.61) L3MBTL1HPGDMAPTATMSMN1; SMN2
SCHEMBL13490745 0.83 L3MBTL1 (0.70) L3MBTL1HPGDMAPTATMSMN1; SMN2
SCHEMBL2810090 0.81 L3MBTL1 (0.50) L3MBTL1HPGDMAPTATMSMN1; SMN2
SCHEMBL2806322 0.81 L3MBTL1 (0.50) L3MBTL1HPGDMAPTATMSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060089355-A1 Methods of treating alzheimer's disease using aromatically substituted w-amino-alkanoic acid amides and alkanoic acid diamides ELAN PHARMACEUTICALS, INC. 2006-04-27 US disclosed
WO-2003103652-A1 METHODS OF TREATING ALZHEIMER’S DISEASE USING AROMATICALLY SUBSTITUTED ω-AMINO-ALKANOIC ACID AMIDES AND ALKANOIC ACID DIAMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed
EP-0716077-A1 Aromatically substituted omega amino alcanoic acid amides and alcanoic diamides and their use as renine inhibitors CIBA-GEIGY AG (CH) 1996-06-12 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-20060089355-A1 Methods of treating alzheimer's disease using aromatically substituted w-amino-alkanoic acid amides and alkanoic acid diamides APP, BACE1, BACE2 L3MBTL1 637/4885HPGD 2228/4885MAPT 282/4885

“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.