SCHEMBL4374329

SCHEMBL4374329

CC(C)(Cc1ccccc1)N(C(=O)c1ccc(-c2ccc(COc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2)cc1)[C@@H](CCC(N)=O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 2/20 0.44
PSEN2 P49810 1/20 0.44
APH1B Q8WW43 1/20 0.44
NCSTN Q92542 1/20 0.44
APH1A Q96BI3 1/20 0.44
PSENEN Q9NZ42 1/20 0.44
GPR34 Q9UPC5 1/20 0.39
MAOB P27338 4/20 0.38
SLC2A1 P11166 1/20 0.37
MRGPRX4 Q96LA9 2/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
PTGES O14684 1/20 0.36
ALOX5 P09917 1/20 0.36
FFAR1 O14842 1/20 0.36
BCL2 P10415 1/20 0.36
NR4A2 P43354 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36

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
SCHEMBL4622870 0.94 PSEN1 (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2247553 0.90 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4623518 0.89 BCL2 (0.43) MAOBRXRARXRBPTGESALOX5
SCHEMBL2247850 0.86 PTGES (0.43) MAOBPTGESALOX5FFAR1BCL2
SCHEMBL2244683 0.86 SPHK2 (0.43) MAOBSLC2A1MRGPRX4PTGESALOX5
SCHEMBL2243828 0.84 EPOR (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2245867 0.83 MMP2 (0.40) PTGESALOX5
SCHEMBL2250531 0.83 HSD17B2 (0.43) MAOBSLC2A1MRGPRX4PTGESALOX5
SCHEMBL2245162 0.82 ERN1 (0.36) PTGESALOX5MEN1KMT2A
SCHEMBL2245193 0.82 MMP2 (0.43) MEN1KMT2A

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-7553873-B2 Glutamate aggrecanase inhibitors WYETH (US) 2009-06-30 US disclosed
EP-1902014-A2 GLUTAMATE AGGRECANASE INHIBITORS Wyeth (US) 2008-03-26 EP disclosed
US-20070043066-A1 Glutamate aggrecanase inhibitors WYETH (US) 2007-02-22 US disclosed
WO-2007008994-A2 GLUTAMATE AGGRECANASE INHIBITORS WYETH (US) 2007-01-18 WO 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-20070043066-A1 Glutamate aggrecanase inhibitors ADAMTS5, ADAMTS1, ADAMTS7 PSEN1 883/4885PSEN2 919/4885APH1B 690/4885

“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.