SCHEMBL6259458

SCHEMBL6259458

N[C@@H](Cc1ncc(-c2ccccc2)o1)C(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.52
NOTUM Q6P988 1/20 0.49
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
RXRG P48443 1/20 0.48
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
FAAH O00519 3/20 0.42
CES1 P23141 1/20 0.42
LTA4H P09960 1/20 0.42
LAP3 P28838 1/20 0.42

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
SCHEMBL6279385 0.86 NOTUM (0.50) FFAR1NOTUMRXRARXRBRXRG
Hydrochloric Acid SCHEMBL6279382 0.85 NOTUM (0.49) FFAR1NOTUMRXRARXRBRXRG
SCHEMBL6273241 0.84 NOTUM (0.48) FFAR1NOTUMRXRARXRBRXRG
Hydrochloric Acid SCHEMBL6273239 0.83 NOTUM (0.47) FFAR1NOTUMRXRARXRBRXRG
SCHEMBL6254236 0.83 NOTUM (0.58) FFAR1NOTUMRXRARXRBRXRG
SCHEMBL6811995 0.83 NOTUM (0.49) FFAR1NOTUMRXRARXRBRXRG
SCHEMBL6260134 0.82 FFAR1 (0.47) FFAR1NOTUMRXRARXRBRXRG
SCHEMBL8325469 0.82 NOTUM (0.48) FFAR1NOTUMRXRARXRBRXRG
Hydrochloric Acid SCHEMBL6811990 0.82 NOTUM (0.48) FFAR1NOTUMRXRARXRBRXRG
Hydrochloric Acid SCHEMBL6260132 0.81 FFAR1 (0.46) FFAR1NOTUMRXRARXRBRXRG

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
EP-1578735-A1 CYCLOPENTYL GLUTARAMIDES AND THEIR USE AS NEUTRAL ENDOPEPTIDASE INHIBITORS Pfizer Limited (GB) 2005-09-28 EP disclosed
US-20040138274-A1 Cardiovascular disorders; hypotensive agents; endopeptidase inhibitor; sexual disorders DACK KEVIN NEIL (GB) 2004-07-15 US disclosed
WO-2004056787-A1 CYCLOPENTYL GLUTARAMIDES AND THEIR USE AS NEUTRAL ENDOPEPTIDASE INHIBITORS PFIZER LIMITED (GB) 2004-07-08 WO disclosed
WO-2004056787-A1 CYCLOPENTYL GLUTARAMIDES AND THEIR USE AS NEUTRAL ENDOPEPTIDASE INHIBITORS PFIZER LIMITED (GB) 2004-07-08 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-20040138274-A1 Cardiovascular disorders; hypotensive agents; endopeptidase inhibitor; sexual disorders MME, ECE1, ECE2 FFAR1 1246/4885NOTUM 331/4885RXRA 4652/4885

“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.