SCHEMBL7801902

SCHEMBL7801902

CCOC(=O)C1CN(Cc2ccccc2)CCN1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.54
ATM Q13315 1/20 0.54
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 3/20 0.49
SIGMAR1 Q99720 2/20 0.47
CCR8 P51685 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
F2 P00734 1/20 0.46
LTA4H P09960 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
SCHEMBL18362774 0.87 KDM4E (0.55) L3MBTL1ATMALDH1A1KDM4ECCR8
SCHEMBL15148260 0.87 F2 (0.48) ALDH1A1KDM4ESIGMAR1MEN1KMT2A
SCHEMBL8563102 0.87 F2 (0.48) ALDH1A1KDM4ESIGMAR1MEN1KMT2A
SCHEMBL2342290 0.84 KMT2A (0.45) L3MBTL1ATMALDH1A1KDM4ESIGMAR1
SCHEMBL16714074 0.83 GRIN2D (0.56) L3MBTL1ALDH1A1SIGMAR1LTA4H
SCHEMBL3815944 0.83 GRIN2D (0.56) L3MBTL1ALDH1A1SIGMAR1LTA4H
SCHEMBL27780998 0.83 SIGMAR1 (0.51) ALDH1A1KDM4ESIGMAR1KMT2AF2
SCHEMBL3815948 0.83 GRIN2D (0.56) L3MBTL1ALDH1A1SIGMAR1LTA4H
SCHEMBL10700987 0.81 L3MBTL1 (0.47) L3MBTL1ATMALDH1A1KDM4ESIGMAR1
SCHEMBL7808456 0.80 SIGMAR1 (0.49) ALDH1A1KDM4ESIGMAR1KMT2AF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0727421-B1 Agents for improving sleep JANSSEN PHARMACEUTICA NV (BE) 2001-10-24 EP disclosed
EP-0727421-A1 Agents for improving sleep JANSSEN PHARMACEUTICA N.V. (BE) 1996-08-21 EP disclosed
US-5191079-A Chemical intermediates for bactericides KANEBO, LTD. (JP) 1993-03-02 US disclosed
US-5166203-A QUINOLINECARBOXYLIC ACID DERIVATIVES, ANTIBACTERIAL AGENT CONTAINING THE SAME KANEBO, LTD. (JP) 1992-11-24 US disclosed
EP-0472826-A2 Novel quinolinecarboxylic acid derivatives, use thereof, antibacterial agent containing the same, process for preparing said compounds and intermediate compound KANEBO LTD. (JP) 1992-03-04 EP disclosed
US-5026853-A Sleep and cardiovascular disorders JANSSEN PHARMACEUTICA N.V. (BE) 1991-06-25 US disclosed
US-4968684-A N-ARYL-PIPERAZINEALKANAMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1990-11-06 US disclosed
US-4880808-A SEDATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1989-11-14 US disclosed
EP-0285219-A2 Method of improving sleep JANSSEN PHARMACEUTICA N.V. (BE) 1988-10-05 EP disclosed
US-4766125-A N-aryl-piperazinealkanamides useful for protecting hearts from myocardial injury caused by ischaemia, anoxia or hypoxia JANSSEN PHARMACEUTICA N.V. (BE) 1988-08-23 US disclosed
EP-0068544-B1 NOVEL N-ARYL-PIPERAZINEALKANAMIDES JANSSEN PHARMACEUTICA N.V. (BE) 1987-06-03 EP disclosed
EP-0068544-A2 Novel N-aryl-piperazinealkanamides JANSSEN PHARMACEUTICA N.V. (BE) 1983-01-05 EP disclosed