SCHEMBL13089694

SCHEMBL13089694

Fc1cccc2cc[n+](Cc3ccccc3)cc12

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 4/20 0.53
▸ BCHE P06276 3/20 0.53
▸ LMNA P02545 3/20 0.44
▸ ALDH1A1 P00352 5/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ HTT P42858 3/20 0.40
▸ CHKA P35790 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ MITF O75030 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ HPGD P15428 1/20 0.39

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
SCHEMBL1127774 0.77 ACHE (0.85) ACHEBCHE
Bromide SCHEMBL3601825 0.75 ACHE (0.89) ACHEBCHE
Hydrochloric Acid SCHEMBL8870693 0.75 ACHE (0.81) ACHEBCHELMNA
SCHEMBL7827657 0.74 ACHE (0.53) ACHEBCHELMNAALDH1A1SMN1; SMN2
Bromide SCHEMBL7991325 0.73 ACHE (0.56) ACHEBCHELMNAALDH1A1SMN1; SMN2
SCHEMBL16492221 0.73 CYP1A2 (0.54) ACHEBCHELMNAALDH1A1SMN1; SMN2
SCHEMBL17790285 0.72 ACHE (0.59) ACHEBCHELMNACYP1A2CYP2D6
Bromide SCHEMBL17783238 0.71 ACHE (0.61) ACHEBCHELMNAALDH1A1SMN1; SMN2
SCHEMBL8870095 0.71 ACHE (0.61) ACHEBCHELMNA
SCHEMBL10692064 0.69 CHKA (0.57) ACHELMNAALDH1A1SMN1; SMN2HTT

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-8476297-B2 TRP-M8 receptor ligands and their use in treatments AMGEN INC. (US) 2013-07-02 — — US disclosed
US-20100261728-A1 TRP-M8 RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2010-10-14 — — US disclosed
WO-2009073203-A1 TRP-M8 RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2009-06-11 — — 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-20100261728-A1 TRP-M8 RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS TRPV1, TRPM8, TRPV2 ACHE 576/4885BCHE 2180/4885LMNA 3765/4885

“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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