SCHEMBL6984254

SCHEMBL6984254

N#CC1Cc2cc3ccsc3cc21

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.35
SLC6A4 P31645 4/20 0.35
SLC6A3 Q01959 4/20 0.35
CYP2D6 P10635 1/20 0.32
CYP2A6 P11509 2/20 0.31

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
SCHEMBL6990292 0.94 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3CYP2D6CYP2A6
SCHEMBL6985110 0.74 MEN1 (0.35)
SCHEMBL3150179 0.68 CYP2A6 (0.41) SLC6A2SLC6A4SLC6A3CYP2D6CYP2A6
SCHEMBL6581524 0.68 IMPDH2 (0.41) SLC6A2SLC6A4SLC6A3CYP2A6
SCHEMBL25639101 0.67 FYN (0.42) SLC6A2SLC6A4SLC6A3CYP2D6CYP2A6
SCHEMBL25639105 0.67 FYN (0.42) SLC6A2SLC6A4SLC6A3CYP2D6CYP2A6
SCHEMBL25639098 0.67 FYN (0.42) SLC6A2SLC6A4SLC6A3CYP2D6CYP2A6
SCHEMBL3028639 0.67 TRPM5 (0.41) SLC6A2SLC6A4
SCHEMBL10292643 0.66 FYN (0.40)
SCHEMBL20260136 0.66 CYP2A6 (0.37) SLC6A2SLC6A4SLC6A3CYP2D6CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1146041-B1 Derivatives of heterocycloalkylbenzocyclobutane and heteroarylbenzocyclobutane and their use as inhibitors of the recapture of serotonine and of noradrenaline SERVIER LAB (FR) 2003-11-12 EP disclosed
US-6420413-B2 1-(6-((DIMETHYLAMINO)METHYL)-1-METHYL-2,3,5,6-TETRAHYDRO-1H -CYCLOBUTA(F) INDOL-6-YL)CYCLOHEXANOL, FOR EXAMPLE; TREATING PSYCHOLOGICAL DISORDERS SUCH AS DEPRESSION, PANIC ATTACKS, PHOBIAS, DRUG ABUSE, AS WELL AS OBESITY AND BULEMIA LES LABORATORIES SERVIER (FR) 2002-07-16 US disclosed
US-20020019380-A1 Heterocycloalkylbenzocyclobutane and heteroarylbenzocyclobutane compounds LES LABORATOIRES SERVIER (FR) 2002-02-14 US disclosed
EP-1146041-A1 Derivatives of heterocycloalkylbenzocyclobutane and heteroarylbenzocyclobutane and their use as inhibitors of the recapture of serotonine and of noradrenaline ADIR ET COMPAGNIE (FR) 2001-10-17 EP 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-20020019380-A1 Heterocycloalkylbenzocyclobutane and heteroarylbenzocyclobutane compounds HSD3B2, HSD3B1, NR1H3 SLC6A2 760/4885SLC6A4 667/4885SLC6A3 546/4885

“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.