SCHEMBL7955773

SCHEMBL7955773

CCC(F)c1cc(N2CCN(CCOS(C)(=O)=O)CC2)cc(Br)c1Cl

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.34
SLC6A4 P31645 4/20 0.34
SLC6A3 Q01959 3/20 0.34
DRD2 P14416 1/20 0.33
CCR1 P32246 1/20 0.30

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
SCHEMBL7581302 0.83 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3CCR1
SCHEMBL7582764 0.82 DRD2 (0.38) DRD2
SCHEMBL7586573 0.80 KDM4E (0.36) DRD2
SCHEMBL7582136 0.79 DRD2 (0.33) DRD2CCR1
SCHEMBL7582141 0.79 KDM4E (0.38) DRD2
SCHEMBL7581291 0.78 KDM4E (0.40) DRD2
SCHEMBL7581935 0.78 KDM4E (0.40) DRD2
SCHEMBL7584470 0.78 DRD2 (0.33) SLC6A2SLC6A4SLC6A3DRD2
SCHEMBL7585537 0.75 DRD4 (0.48) DRD2
SCHEMBL7585007 0.74 MAPT (0.51) CCR1

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
US-6281214-B1 USEFUL FOR TREATING AND AMELIORATING MENTAL DISORDERS EISAI CO., LTD (JP) 2001-08-28 US disclosed
EP-0675118-A2 Biphenylderivatives, process for their preparation and their use as medicaments Eisai Co., Ltd. (JP) 1995-10-04 EP disclosed