SCHEMBL3366239

SCHEMBL3366239

C[N]C1CCN(Cc2ccccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 9/20 0.67
▸ BACE1 P56817 9/20 0.67
▸ BCHE P06276 6/20 0.59
▸ CCR3 P51677 1/20 0.59
▸ SIGMAR1 Q99720 1/20 0.59
▸ DRD2 P14416 1/20 0.56
▸ DRD4 P21917 1/20 0.56
▸ DRD3 P35462 1/20 0.56
▸ MC4R P32245 1/20 0.55
▸ LMNA P02545 1/20 0.53
▸ POLB P06746 1/20 0.53

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
SCHEMBL5121429 0.90 BCHE (0.64) ACHEBACE1BCHECCR3
SCHEMBL5091801 0.82 ACHE (0.62) ACHEBACE1BCHECCR3SIGMAR1
SCHEMBL41919 0.82 ACHE (0.62) ACHEBACE1BCHECCR3SIGMAR1
SCHEMBL14636487 0.80 ACHE (0.58) ACHEBACE1BCHECCR3SIGMAR1
SCHEMBL14636486 0.80 ACHE (0.58) ACHEBACE1BCHECCR3SIGMAR1
SCHEMBL3367341 0.80 CYP2D6 (0.60) ACHEBACE1BCHE
SCHEMBL156315 0.79 ACHE (1.00) ACHEBACE1BCHECCR3SIGMAR1
SCHEMBL8315434 0.79 ACHE (0.71) ACHEBACE1BCHECCR3SIGMAR1
SCHEMBL22872251 0.79 ACHE (0.66) ACHEBACE1BCHECCR3SIGMAR1
SCHEMBL5909546 0.78 CCR3 (0.63) ACHEBCHECCR3SIGMAR1

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
EP-1730115-B1 5-AMINOALKYLPYRAZOLE DERIVATIVES AS PESTICIDAL AGENTS MERIAL LTD (US) 2010-06-09 — — EP disclosed
US-7659288-B2 5-[N-Methyl-N-(phthalimidomethyl)amino]-1-(2,6-dichloro-4-trifluoromethylphenyl)-3-cyano-4-trifluoromethylsulfinylpyrazole; used in oral form so as to prevent the possible contamination of humans or the surrounding environment; used in lower dose MERIAL LIMITED (US) 2010-02-09 — — US disclosed
US-20070149575-A1 5-Aminoalkylpyrazole derivatives as pesticidal agents MERIAL, INC. 2007-06-28 — — US 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-20070149575-A1 5-Aminoalkylpyrazole derivatives as pesticidal agents DDT, AASDHPPT, ACHE ACHE 3/4885BACE1 2214/4885BCHE 108/4885

“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.

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