SCHEMBL11170237

SCHEMBL11170237

CC1CCc2c(Cl)cccc2N1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.41
HTR1A P08908 7/20 0.41
HTR7 P34969 7/20 0.41
HTR5A P47898 7/20 0.41
HTR1D P28221 4/20 0.41
HTR2A P28223 2/20 0.38
HTR3A P46098 2/20 0.38
HTR6 P50406 1/20 0.38
HRH1 P35367 1/20 0.38
ADRA2A P08913 2/20 0.37
ADRA2B P18089 2/20 0.37
ADRA2C P18825 2/20 0.37
BRD4 O60885 4/20 0.37
CREBBP Q92793 3/20 0.37
CYP2D6 P10635 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
PNMT P11086 1/20 0.36
MEN1 O00255 1/20 0.35

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
SCHEMBL11170515 0.81 BRD4 (0.44) HTR2CHTR1AHTR7HTR5AHTR1D
SCHEMBL22279675 0.80 CREBBP (0.41) HTR2CHTR5AADRA2AADRA2BADRA2C
SCHEMBL24814721 0.79 BRD4 (0.35) BRD4CREBBPMEN1GAAKMT2A
SCHEMBL11162775 0.79 NOTUM (0.50) HTR2CHTR1AHTR7HTR5AHTR1D
SCHEMBL30047998 0.79 BRD4 (0.35) BRD4CREBBPMEN1GAAKMT2A
SCHEMBL16729472 0.79 DRD2 (0.41) HTR1AHTR7
SCHEMBL14826475 0.78 ALDH1A1 (0.35) BRD4CREBBPEP300
Bromide SCHEMBL16717336 0.77 DRD2 (0.40) HTR1AHTR7
Bromide SCHEMBL16717340 0.77 DRD2 (0.40) HTR1AHTR7
SCHEMBL30330058 0.76 MTNR1A (0.52) HTR1AHTR5AADRA2ACYP2D6ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4416884-A ANTIBIOTIC, BACTERICIDE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1983-11-22 US disclosed
US-4014877-A MICROBIOCIDES RIKER LABORATORIES, INC. (US) 1977-03-29 US disclosed
US-4001243-A ANTI-MICROBIAL RIKER LABORATORIES, INC. (US) 1977-01-04 US disclosed
US-3985882-A ADMISTERING RIKER LABORATORIES, INC. (US) 1976-10-12 US disclosed
US-3969463-A MICROBIOCIDE RIKER LABORATORIES, INC. (US) 1976-07-13 US disclosed