SCHEMBL4591737

SCHEMBL4591737

Cc1c[nH]c(=O)c(C(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 2/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ KDM4E B2RXH2 2/20 0.52
▸ CRHBP P24387 1/20 0.52
▸ CRHR2 Q13324 1/20 0.52
▸ PARP1 P09874 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ EPHX1 P07099 1/20 0.49
▸ MAPT P10636 2/20 0.49
▸ LMNA P02545 2/20 0.48
▸ THRB P10828 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ USP30 Q70CQ3 1/20 0.47

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
SCHEMBL31572401 0.80 EPHX2 (0.56) EPHX2MEN1KMT2APARP1EPHX1
SCHEMBL19639670 0.78 L3MBTL1 (0.47) EPHX2MEN1KMT2AALDH1A1KDM4E
SCHEMBL29268419 0.77 NPC1 (0.61) EPHX2MEN1KMT2AEPHX1MAPT
SCHEMBL8366262 0.76 KMT2A (0.70) EPHX2MEN1KMT2AALDH1A1KDM4E
SCHEMBL28579659 0.74 USP30 (0.52) MEN1KMT2AALDH1A1KDM4ECRHBP
SCHEMBL4852930 0.74 USP30 (0.58) EPHX2MEN1KMT2AALDH1A1KDM4E
SCHEMBL23534299 0.74 L3MBTL1 (0.49) MEN1KMT2AALDH1A1KDM4ECRHBP
SCHEMBL2953693 0.73 SMYD3 (0.58) EPHX2MEN1KMT2AEPHX1MAPT
SCHEMBL22083658 0.73 USP30 (0.56) MEN1KMT2AALDH1A1KDM4EPARP1
SCHEMBL22160845 0.73 SMYD3 (0.58) EPHX2KMT2AALDH1A1PARP1L3MBTL1

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
EP-1893603-A1 PIPERIDIN-4-YL-AMIDE DERIVATIVES AND THEIR USE AS SST RECEPTOR SUBTYPE 5 ANTAGONISTS F. Hoffmann-La Roche AG (CH) 2008-03-05 — — EP disclosed
WO-2006128803-A1 PIPERIDIN-4-YL-AMIDE DERIVATIVES AND THEIR USE AS SST RECEPTOR SUBTYPE 5 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-12-07 — — WO disclosed
Send feedback