SCHEMBL6982079

SCHEMBL6982079

CCNc1c(C)c(C)c2c(c1C)CC(C)(CN1CCC(c3ccccc3)CC1)O2

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.43
CARM1 Q86X55 1/20 0.38
PRMT6 Q96LA8 1/20 0.38
SLC18A3 Q16572 3/20 0.38
HTR7 P34969 2/20 0.36
SLC6A4 P31645 1/20 0.34
DRD4 P21917 3/20 0.33
DRD3 P35462 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
DRD1 P21728 1/20 0.33
DRD5 P21918 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA1B P35368 1/20 0.33

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
SCHEMBL6980360 0.85 SLC18A3 (0.40) DRD2SLC18A3HTR7DRD4DRD3
SCHEMBL6985836 0.84 DRD2 (0.40) DRD2HTR7DRD4DRD3MEN1
SCHEMBL7811043 0.83 DRD2 (0.43) DRD2CARM1PRMT6SLC18A3HTR7
SCHEMBL6981562 0.83 DRD2 (0.43) DRD2CARM1PRMT6SLC18A3HTR7
SCHEMBL6981384 0.83 DRD2 (0.43) DRD2CARM1PRMT6SLC18A3HTR7
Hydrochloric Acid SCHEMBL6980227 0.83 DRD2 (0.40) DRD2HTR7DRD4DRD3MEN1
Hydrochloric Acid SCHEMBL6985847 0.82 DRD2 (0.42) DRD2CARM1PRMT6SLC18A3HTR7
Bromide SCHEMBL7811677 0.82 DRD2 (0.42) DRD2CARM1PRMT6SLC18A3HTR7
Hydrochloric Acid SCHEMBL7811763 0.82 DRD2 (0.42) DRD2CARM1PRMT6SLC18A3HTR7
Bromide SCHEMBL7811682 0.82 DRD2 (0.42) DRD2CARM1PRMT6SLC18A3HTR7

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-0923575-B1 CYCLIC ETHER COMPOUNDS AS SODIUM CHANNEL MODULATORS TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-03-12 EP disclosed
US-6172085-B1 CENTRAL NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-01-09 US disclosed