SCHEMBL3845788

SCHEMBL3845788

CC(=O)CN1CCC(CCN2CCN(c3ccc(C)cc3F)CC2)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
KMT2A Q03164 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 3/20 0.42
TSHR P16473 2/20 0.42
LMNA P02545 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TAAR1 Q96RJ0 1/20 0.41
DRD2 P14416 3/20 0.41
DRD3 P35462 3/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
DRD4 P21917 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTT P42858 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
SCHEMBL3844154 0.91 FFAR4 (0.48) MAPTKMT2AALDH1A1TSHRLMNA
SCHEMBL3844840 0.90 ADRA1B (0.47) MAPTL3MBTL1DRD2DRD3
SCHEMBL3851537 0.88 SLC6A2 (0.45) MAPTL3MBTL1DRD2DRD3DRD4
SCHEMBL3849069 0.87 CHRM2 (0.49) MAPTL3MBTL1DRD2DRD3
SCHEMBL13419249 0.87 ALDH1A1 (0.50) MAPTKMT2AL3MBTL1ALDH1A1TSHR
SCHEMBL3844984 0.87 ALDH1A1 (0.56) MAPTKMT2AALDH1A1TSHRLMNA
SCHEMBL3849428 0.86 CHRM4 (0.43) MAPTALDH1A1DRD2DRD3DRD4
SCHEMBL3851246 0.85 KDM4E (0.55) MAPTKMT2AL3MBTL1ALDH1A1TSHR
SCHEMBL3844646 0.85 DRD2 (0.43) KMT2AALDH1A1TSHRDRD2DRD3
SCHEMBL3845719 0.85 FFAR4 (0.48) MAPTALDH1A1TSHRLMNADRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090286801-A1 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2009-11-19 US claimed
EP-2038268-A2 CARBONYLATED (AZA)CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2009-03-25 EP claimed
WO-2007148208-A2 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2007-12-27 WO claimed
EP-2038268-B1 CARBONYLATED (AZA)CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET SOC CIV (FR) 2015-11-04 EP disclosed
EP-2038268-B1 CARBONYLATED (AZA)CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET SOC CIV (FR) 2015-11-04 EP disclosed
US-8802678-B2 Carbonylated (aza) cyclohexanes as dopamine D3 receptor ligands BIOPROJET (FR) 2014-08-12 US disclosed
US-20090286801-A1 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2009-11-19 US disclosed
US-20090286801-A1 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2009-11-19 US disclosed
US-20090286801-A1 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2009-11-19 US disclosed
WO-2007148208-A2 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS BIOPROJET (FR) 2007-12-27 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-20090286801-A1 CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS DRD3, TACR2, TACR1 MAPT 2805/4885KMT2A 2085/4885L3MBTL1 4658/4885

“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.