SCHEMBL6965746

SCHEMBL6965746

Fc1ccc(C2CCN(C3CCC(COCCc4cc(C(F)(F)F)cc(C(F)(F)F)c4)(c4ccccc4)CC3)CC2)cc1

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 20/20 0.83
SLC6A4 P31645 2/20 0.62

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
SCHEMBL6481748 0.91 TACR1 (1.00) TACR1SLC6A4
SCHEMBL6485107 0.86 TACR1 (1.00) TACR1SLC6A4
SCHEMBL6485102 0.86 TACR1 (1.00) TACR1SLC6A4
SCHEMBL6485283 0.82 TACR1 (1.00) TACR1
SCHEMBL6484906 0.82 TACR1 (1.00) TACR1
SCHEMBL6483302 0.82 TACR1 (1.00) TACR1
SCHEMBL6482696 0.81 TACR1 (1.00) TACR1SLC6A4
SCHEMBL6483957 0.81 TACR1 (1.00) TACR1SLC6A4
SCHEMBL6492406 0.81 TACR1 (1.00) TACR1SLC6A4
SCHEMBL6495512 0.81 TACR1 (1.00) TACR1SLC6A4

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-1286978-A1 CYCLOHEXYL DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LTD. (GB) 2003-03-05 EP disclosed
WO-2001087866-A1 CYCLOHEXYL DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LIMITED (GB) 2001-11-22 WO disclosed