SCHEMBL8690982

SCHEMBL8690982

OC(COc1cccc2[nH]ccc12)CN1CC=C(c2c[nH]c3cc(F)ccc23)CC1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 18/20 0.60
SLC6A4 P31645 9/20 0.60
ADRA1D P25100 1/20 0.51
ADRA1A P35348 1/20 0.51
ADRA1B P35368 1/20 0.51

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
SCHEMBL7884157 1.00 HTR1A (0.60) HTR1ASLC6A4ADRA1DADRA1AADRA1B
SCHEMBL7885650 0.94 HTR1A (0.59) HTR1ASLC6A4ADRA1DADRA1AADRA1B
SCHEMBL8695915 0.94 HTR1A (0.59) HTR1ASLC6A4ADRA1DADRA1AADRA1B
SCHEMBL7883019 0.92 HTR1A (0.60) HTR1ASLC6A4ADRA1DADRA1AADRA1B
SCHEMBL8694826 0.91 HTR1A (0.59) HTR1ASLC6A4ADRA1DADRA1AADRA1B
SCHEMBL7885660 0.91 HTR1A (0.59) HTR1ASLC6A4ADRA1DADRA1AADRA1B
SCHEMBL7885557 0.90 HTR1A (0.57) HTR1ASLC6A4ADRA1DADRA1AADRA1B
SCHEMBL8696595 0.90 HTR1A (0.57) HTR1ASLC6A4ADRA1DADRA1AADRA1B
SCHEMBL8695028 0.90 HTR1A (0.58) HTR1ASLC6A4ADRA1DADRA1AADRA1B
SCHEMBL8872506 0.90 HTR1A (0.58) HTR1ASLC6A4ADRA1DADRA1AADRA1B

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-5789402-A Compounds having effects on serotonin-related systems ELI LILLY COMPANY (US) 1998-08-04 US disclosed
US-5741789-A HETERO-OXY ALKANAMINES ELI LILLY AND COMPANY (US) 1998-04-21 US disclosed