SCHEMBL6616969

SCHEMBL6616969

CN1C(=O)N(Cc2ccccc2)C(=O)CC1CN1CCC(Cc2cc(F)ccc2Br)CC1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 11/20 0.44
SLC6A4 P31645 11/20 0.44
ATM Q13315 1/20 0.41
CCR3 P51677 1/20 0.38

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
SCHEMBL6615215 0.90 SLC6A4 (0.45) HTR1ASLC6A4ATMCCR3
SCHEMBL6614539 0.90 SLC6A4 (0.46) HTR1ASLC6A4ATM
SCHEMBL6618489 0.88 HTR1A (0.61) HTR1ASLC6A4
SCHEMBL6614593 0.86 HTR1A (0.50) HTR1ASLC6A4
SCHEMBL6616780 0.86 HTR1A (0.50) HTR1ASLC6A4
SCHEMBL6412511 0.86 HTR1A (0.46) HTR1ASLC6A4ATMCCR3
SCHEMBL6410588 0.86 HTR1A (0.46) HTR1ASLC6A4ATMCCR3
SCHEMBL6614583 0.86 SLC6A4 (0.42) HTR1ASLC6A4ATM
SCHEMBL6615250 0.82 MEN1 (0.43) HTR1ASLC6A4ATMCCR3
SCHEMBL6614883 0.81 SLC6A4 (0.43) HTR1ASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1466901-A1 SEROTONINE REUPTAKE INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-10-13 EP disclosed