SCHEMBL7414475

SCHEMBL7414475

NC(=O)C1CCN(C(=O)NC(=O)Cc2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.60
▸ SMN1; SMN2 Q16637 5/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ ALDH1A1 P00352 3/20 0.55
▸ GAA P10253 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ KMT2A Q03164 2/20 0.50
▸ PKM P14618 1/20 0.49
▸ RAB9A P51151 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ LMNA P02545 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ SIGMAR1 Q99720 1/20 0.47
▸ MAPT P10636 1/20 0.46

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
SCHEMBL8403770 0.89 L3MBTL1 (0.67) SMN1; SMN2ALDH1A1L3MBTL1NPSR1KMT2A
SCHEMBL7414197 0.85 SIGMAR1 (0.50) ALDH1A1L3MBTL1NPSR1KMT2AMEN1
SCHEMBL7412504 0.81 GAA (0.57) KDM4ESMN1; SMN2ALDH1A1GAAL3MBTL1
SCHEMBL8066357 0.80 GAA (0.59) KDM4ESMN1; SMN2ALDH1A1GAAL3MBTL1
SCHEMBL7412108 0.77 POLB (0.55) KDM4EALDH1A1GAAL3MBTL1KMT2A
SCHEMBL17117483 0.76 ALDH1A1 (0.66) KDM4ESMN1; SMN2CYP2C19ALDH1A1GAA
SCHEMBL8188060 0.76 KMT2A (0.47) ALDH1A1L3MBTL1KMT2APKMLMNA
SCHEMBL8329590 0.75 FAAH (0.49) KDM4EALDH1A1KMT2ALMNAMEN1
SCHEMBL5369479 0.73 POLB (0.78) KDM4ESMN1; SMN2CYP2C19ALDH1A1L3MBTL1
SCHEMBL5370503 0.73 ALDH1A1 (0.77) KDM4ESMN1; SMN2CYP2C19ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000002903-A1 CS-1 PEPTIDOMIMETICS, COMPOSITIONS AND METHODS OF USING THE SAME CYTEL CORPORATION (US) 2000-01-20 — — WO disclosed
Send feedback