SCHEMBL8429437

SCHEMBL8429437

CCCCN1CCC(c2c[nH]c3ccc(NC(=S)NCCCc4ccccc4)cc23)CC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 2/20 0.52
HTR1D P28221 17/20 0.51
HTR1B P28222 14/20 0.50
CHRM2 P08172 1/20 0.50
DRD2 P14416 1/20 0.50

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
SCHEMBL7481656 0.87 HTR1D (0.57) HTR1DHTR1BCHRM2DRD2
SCHEMBL7480624 0.86 HTR1D (0.46) CCR2HTR1DHTR1B
SCHEMBL7480617 0.86 CCR2 (0.61) CCR2HTR1DHTR1BCHRM2DRD2
SCHEMBL7484437 0.83 HTR1D (0.55) CCR2HTR1DHTR1BCHRM2DRD2
SCHEMBL8383630 0.82 SLC6A4 (0.43) HTR1DHTR1B
SCHEMBL7483472 0.82 HTR1D (0.66) CCR2HTR1DHTR1BCHRM2DRD2
SCHEMBL7489650 0.81 HTR1D (0.60) HTR1DHTR1BCHRM2DRD2
SCHEMBL7480051 0.80 HTR1D (0.52) HTR1DHTR1BCHRM2DRD2
SCHEMBL7481803 0.80 HTR1D (0.74) HTR1DHTR1BCHRM2DRD2
SCHEMBL7477707 0.80 HTR1D (0.64) HTR1DHTR1B

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
US-5962474-A ANALGESICS; HEADACHES ELI LILLY AND COMPANY (US) 1999-10-05 US disclosed