SCHEMBL6447897

SCHEMBL6447897

COCCOCC(=O)NC(C(=O)O)C(C)C

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MBTPS1 Q14703 1/20 0.45
SDCBP O00560 4/20 0.43
SDC2 P34741 4/20 0.43
ALDH1A1 P00352 1/20 0.41
NPSR1 Q6W5P4 2/20 0.41
PPARG P37231 2/20 0.38
PPARA Q07869 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
PLA2G2A P14555 1/20 0.36
PLA2G5 P39877 1/20 0.36
POLB P06746 1/20 0.36
FPR2 P25090 1/20 0.36
MAPK1 P28482 1/20 0.35

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
SCHEMBL6443618 1.00 MBTPS1 (0.45) MBTPS1SDCBPSDC2ALDH1A1NPSR1
SCHEMBL5711380 0.84 MBTPS1 (0.50) MBTPS1SDCBPSDC2ALDH1A1NPSR1
SCHEMBL7708004 0.84 POLB (0.35) MBTPS1SDCBPSDC2POLB
SCHEMBL21274309 0.83 MBTPS1 (0.45) MBTPS1SDCBPSDC2ALDH1A1NPSR1
SCHEMBL21274311 0.83 MBTPS1 (0.45) MBTPS1SDCBPSDC2ALDH1A1NPSR1
SCHEMBL12448079 0.80 LMNA (0.39) ALDH1A1SMN1; SMN2MAPK1
SCHEMBL6444840 0.80 KLK5 (0.38) SDCBPSDC2ALDH1A1POLB
SCHEMBL27097551 0.79 LMNA (0.38) ALDH1A1SMN1; SMN2MAPK1
SCHEMBL27097552 0.79 LMNA (0.38) ALDH1A1SMN1; SMN2MAPK1
SCHEMBL27097550 0.79 LMNA (0.38) ALDH1A1SMN1; SMN2MAPK1

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 5 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-0604368-A1 Anti retroviral hydrazine derivatives CIBA-GEIGY AG (CH) 1994-06-29 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 MBTPS1 2055/4885SDCBP 3079/4885SDC2 3257/4885

“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.