SCHEMBL6451928

SCHEMBL6451928

CC(=O)NC(C)CCC[O]

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.40
MTNR1A P48039 8/20 0.38
MTNR1B P49286 8/20 0.38
ALDH1A1 P00352 1/20 0.38
ACACB O00763 6/20 0.36
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
ALOX15 P16050 1/20 0.34
NFKB1 P19838 1/20 0.34
PTGS2 P35354 1/20 0.34
THPO P40225 1/20 0.34
RECQL P46063 1/20 0.34
BLM P54132 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL20257406 0.82 TRPV1 (0.40) TRPV1MTNR1AMTNR1BALDH1A1ACACB
SCHEMBL9888804 0.82 ALDH1A1 (0.42) TRPV1MTNR1AMTNR1BALDH1A1ACACB
SCHEMBL6451931 0.82 TRPV1 (0.40) TRPV1MTNR1AMTNR1BALDH1A1ACACB
SCHEMBL2760205 0.82 TAS1R3 (0.50) TRPV1ACACBTAS1R3TAS1R1TAS1R2
SCHEMBL1805743 0.80 ADH1B (0.48) TRPV1TAS1R3TAS1R1TAS1R2
SCHEMBL20149715 0.80 TRPV1 (0.39) TRPV1MTNR1AMTNR1BALDH1A1ACACB
SCHEMBL20149709 0.79 CHRNB2 (0.48) TRPV1MTNR1AMTNR1BACACB
SCHEMBL18610940 0.79
SCHEMBL20149718 0.78 ALDH1A1 (0.41) TRPV1MTNR1AMTNR1BALDH1A1ACACB
SCHEMBL7217246 0.78 ADH1B (0.52) TRPV1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050130941-A1 Methods of treating alzheimer's disease PHARMACIA & UPJOHN COMPANY LLC 2005-06-16 US disclosed
EP-1392315-A1 METHODS OF TREATING ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2004-03-03 EP disclosed
WO-2002100410-A1 METHODS OF TREATING ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-12-19 WO disclosed
US-5753652-A Antiretroviral hydrazine derivatives NOVARTIS CORPORATION (US) 1998-05-19 US disclosed
EP-0521827-B1 Pharmacological active hydrazin derivatives and process for their preparation CIBA GEIGY AG (CH) 1996-09-25 EP disclosed
EP-0521827-A1 Pharmacological active hydrazin derivatives and process for their preparation CIBA-GEIGY AG (CH) 1993-01-07 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-20050130941-A1 Methods of treating alzheimer's disease BACE1, PSEN1, BACE2 TRPV1 4340/4885MTNR1A 198/4885MTNR1B 134/4885

“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.