SCHEMBL8936189

SCHEMBL8936189

CC1(N)CCc2cc(Cl)ccc2C1=O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.45
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
SRD5A1 P18405 11/20 0.44
SRD5A2 P31213 2/20 0.42
METAP1 P53582 1/20 0.40
HTT P42858 1/20 0.40
DGAT1 O75907 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TYMS P04818 1/20 0.40
KDM1A O60341 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
Hydrochloric Acid SCHEMBL8665861 0.98 DRD2 (0.44) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL9587877 0.85 HTR2A (0.46) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL8936183 0.82 DRD2 (0.47) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL8779094 0.77 SIGMAR1 (0.57) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL14358027 0.75 SIGMAR1 (0.56) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL29448019 0.74 METAP1 (0.43) DRD2HTR2AHTR2CSRD5A1SRD5A2
SCHEMBL14430319 0.74 METAP1 (0.43) DRD2HTR2AHTR2CSRD5A1SRD5A2
SCHEMBL8936164 0.73 SMN1; SMN2 (0.41) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL9600590 0.73 SRD5A1 (0.43) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL8665382 0.73 SRD5A1 (0.43) DRD2HTR2AHTR2CHTR2BSIGMAR1

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-5514678-A Arthropodicidal 1,2,4-triazinyl amides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-05-07 US disclosed