SCHEMBL6991655

SCHEMBL6991655

COc1ccccc1CN1CCN(C(=O)C(C)(C)C)CC1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.65
ALOX15 P16050 1/20 0.65
ALDH1A1 P00352 6/20 0.64
HTT P42858 2/20 0.64
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
LMNA P02545 2/20 0.58
CYP2D6 P10635 3/20 0.58
TSHR P16473 1/20 0.58
MAPT P10636 1/20 0.57

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
SCHEMBL31464036 0.85 CYP2D6 (0.78) KDM4EALOX15ALDH1A1HTTKMT2A
SCHEMBL27140798 0.81 KDM4E (0.73) KDM4EALOX15ALDH1A1HTTKMT2A
SCHEMBL11633489 0.81 ALDH1A1 (0.70) KDM4EALOX15ALDH1A1HTTKMT2A
SCHEMBL31708875 0.81 KDM4E (0.61) KDM4EALOX15ALDH1A1HTTKMT2A
SCHEMBL21044159 0.79 MEN1 (0.70) KDM4EALOX15ALDH1A1HTTKMT2A
SCHEMBL27882880 0.78 KDM4E (0.60) KDM4EALOX15ALDH1A1HTTKMT2A
SCHEMBL30064669 0.78 KDM4E (0.67) KDM4EALOX15ALDH1A1HTTKMT2A
SCHEMBL3602510 0.78 FAAH (0.69) KDM4EALOX15ALDH1A1KMT2AMEN1
SCHEMBL27615799 0.78 MEN1 (0.64) KDM4EALOX15ALDH1A1HTTKMT2A
SCHEMBL12856249 0.78 MEN1 (0.72) KDM4EALOX15ALDH1A1HTTKMT2A

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-1332127-A2 AMIDINO-UREA SEROTONIN RECEPTOR LIGANDS AND COMPOSITIONS, THEIR PHARMACEUTICAL USES, AND METHODS FOR THEIR SNYTHESIS Warner-Lambert Company LLC (US) 2003-08-06 EP disclosed
WO-2002036554-A2 AMIDINO-UREA SEROTONIN RECEPTOR LIGANDS AND COMPOSITIONS, THEIR PHARMACEUTICAL USES, AND METHODS FOR THEIR SNYTHESIS WARNER-LAMBERT COMPANY LLC (US) 2002-05-10 WO disclosed