SCHEMBL8938536

SCHEMBL8938536

O=C(c1nc2ccccc2s1)[C@@H]1CCCN1C(=O)[C@@H]1Cc2ccccc2N1C(=O)CCCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
PREP P48147 1/20 0.41
F2 P00734 1/20 0.39
HCRTR1 O43613 1/20 0.39
HCRTR2 O43614 1/20 0.39

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
SCHEMBL8938600 0.87 MEN1 (0.45) MAPTF2HCRTR1HCRTR2
SCHEMBL8938431 0.85 PREP (0.47) MAPTLMNAPREP
SCHEMBL8938442 0.84 PKM (0.42) MAPTPREP
SCHEMBL8938625 0.80 MEN1 (0.40) F2
SCHEMBL8938630 0.79 PREP (0.42) MAPTPREP
SCHEMBL8938395 0.79 FAAH (0.43) PREP
SCHEMBL8938389 0.75 PREP (0.59) MAPTLMNAPREP
SCHEMBL8938499 0.74 MEN1 (0.48) PREPF2
SCHEMBL8079479 0.73 PREP (0.55) MAPTLMNAPREP
SCHEMBL8938473 0.72 PREP (0.56) PREPF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5547978-A ENDOPEPTIDASE INHIBITORS MEIJI SEIKA KAISHA, LTD. (JP) 1996-08-20 US claimed
US-5547978-A ENDOPEPTIDASE INHIBITORS MEIJI SEIKA KAISHA, LTD. (JP) 1996-08-20 US disclosed