SCHEMBL7121075

SCHEMBL7121075

CN1C2CCC1CC(F)(c1ccccc1)C2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 5/20 0.53
SLC6A4 P31645 4/20 0.53
SLC6A2 P23975 4/20 0.53
MAOB P27338 6/20 0.42
MAOA P21397 3/20 0.42
SIGMAR1 Q99720 3/20 0.42
DRD2 P14416 2/20 0.42
OPRM1 P35372 3/20 0.41
OPRL1 P41146 2/20 0.41
CHRM3 P20309 4/20 0.40
CHRM2 P08172 3/20 0.40
CHRM1 P11229 3/20 0.40
HRH2 P25021 2/20 0.40
OPRD1 P41143 2/20 0.40
OPRK1 P41145 2/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40

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
SCHEMBL5194656 0.78 SLC6A4 (0.74) SLC6A3SLC6A4SLC6A2DRD2OPRM1
SCHEMBL14660878 0.75 ALDH1A1 (0.41) MAOBMAOAOPRM1OPRL1HTR2A
SCHEMBL26947621 0.75 OPRM1 (0.44) SLC6A3SLC6A4SLC6A2SIGMAR1DRD2
SCHEMBL11173935 0.74 OPRL1 (0.60) SLC6A3SLC6A4SLC6A2SIGMAR1DRD2
SCHEMBL7456864 0.74 SLC6A4 (0.49) SLC6A3SLC6A4SLC6A2SIGMAR1DRD2
SCHEMBL1843464 0.74 OPRL1 (0.60) SLC6A3SLC6A4SLC6A2SIGMAR1DRD2
SCHEMBL11173936 0.74 OPRL1 (0.60) SLC6A3SLC6A4SLC6A2SIGMAR1DRD2
SCHEMBL10472288 0.72 SLC6A3 (0.44) SLC6A3SLC6A4SLC6A2SIGMAR1DRD2
SCHEMBL10472289 0.72 SLC6A3 (0.44) SLC6A3SLC6A4SLC6A2SIGMAR1DRD2
SCHEMBL12975991 0.71 MAOB (0.47) MAOBMAOAHTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6670375-B2 Particularly, 8-aza-, 8-carbo- and 8-oxo- tropanes having 6-or 7-substituents; preferred are the dopamine transporter, the serotonin transporter and the norepinephrine transporter. ORGANIX, INC. 2003-12-30 US disclosed
US-20020010207-A1 Tropane analogs and methods for inhibition of monoamine transport WILMINGTON TRUST (LONDON) LIMITED, AS SECURITY AGENT (GB) 2002-01-24 US disclosed
WO-1995011901-A9 SUBSTITUTED 2-CARBOXYALKYL-3-(FLUOROPHENYL)-8-(3-HALOPROPEN-2-YL) NORTROPANES AND THEIR USE AS IMAGING AGENTS FOR NEURODEGENERATIVE DISORDERS 1995-06-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020010207-A1 Tropane analogs and methods for inhibition of monoamine transport SLC6A2, SLC6A4, SLC6A3 SLC6A3 3/4885SLC6A4 2/4885SLC6A2 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.