SCHEMBL7848593

SCHEMBL7848593

Cc1cccc(C)c1NC(=O)CN1CCC(Cc2c[nH]c3ccc(F)cc23)CC1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.49
MAPK1 P28482 1/20 0.48

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
SCHEMBL7843427 0.83 MEN1 (0.52) SLC6A4MAPK1
SCHEMBL5727535 0.74 SLC6A4 (0.63) SLC6A4MAPK1
SCHEMBL13499597 0.74 SLC6A4 (0.69) SLC6A4MAPK1
SCHEMBL26996488 0.72 SLC6A4 (0.83) SLC6A4MAPK1
Oxalic Acid SCHEMBL9425948 0.72 SLC6A4 (0.51) SLC6A4MAPK1
Hydrochloric Acid SCHEMBL3206106 0.72 ALDH1A1 (0.61) SLC6A4
SCHEMBL7438817 0.71 ALDH1A1 (0.66) SLC6A4
SCHEMBL2327539 0.71 ALDH1A1 (0.64) SLC6A4
SCHEMBL8299563 0.71 HTR1D (0.66)
SCHEMBL5726423 0.71 BRD3 (0.55) SLC6A4MAPK1

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-1076658-A1 SEROTONERGIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 2001-02-21 EP claimed
WO-1999055697-A1 SEROTONERGIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-11-04 WO claimed