SCHEMBL6447570

SCHEMBL6447570

NN(Cc1ccccc1)CC(O)C(Cc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSB P07858 3/20 0.66
SPPL2A Q8TCT8 1/20 0.53
TRPM8 Q7Z2W7 1/20 0.53
CTRB1 P17538 2/20 0.51
F2 P00734 1/20 0.49
PLAU P00749 1/20 0.49
PLAT P00750 1/20 0.49
PSEN1 P49768 2/20 0.47
PSEN2 P49810 2/20 0.47
APH1B Q8WW43 2/20 0.47
NCSTN Q92542 2/20 0.47
APH1A Q96BI3 2/20 0.47
PSENEN Q9NZ42 2/20 0.47
TACR1 P25103 2/20 0.46
CTSL P07711 3/20 0.46
CTSS P25774 2/20 0.46
CTSK P43235 2/20 0.46
CTSD P07339 1/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL6447573 1.00 CTSB (0.66) CTSBSPPL2ATRPM8CTRB1F2
SCHEMBL3553822 0.86 CTSB (0.48) CTSBSPPL2APSEN1PSEN2APH1B
SCHEMBL3553819 0.86 CTSB (0.48) CTSBSPPL2APSEN1PSEN2APH1B
SCHEMBL9202646 0.86 CTSB (0.60) CTSBSPPL2ATRPM8CTRB1F2
SCHEMBL2601896 0.85 CTSB (0.71) CTSBSPPL2ATRPM8CTRB1PSEN1
SCHEMBL2601897 0.85 CTSB (0.71) CTSBSPPL2ATRPM8CTRB1PSEN1
SCHEMBL6945451 0.85 CTSB (0.62) CTSBSPPL2ATRPM8CTRB1F2
SCHEMBL17754421 0.85 CTSB (0.71) CTSBSPPL2ATRPM8CTRB1PSEN1
SCHEMBL17754419 0.85 CTSB (0.71) CTSBSPPL2ATRPM8CTRB1PSEN1
SCHEMBL7320613 0.83 TRPM8 (0.58) CTSBSPPL2ATRPM8CTRB1F2

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-20050130941-A1 Methods of treating alzheimer's disease PHARMACIA & UPJOHN COMPANY LLC 2005-06-16 US 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 CTSB 41/4885SPPL2A 1033/4885TRPM8 3777/4885

“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.