SCHEMBL21750879

SCHEMBL21750879

Fc1c(F)c(F)c([B-](Cc2ccccc2)(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F.c1ccc(C[n+]2ccc3ccccc3c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACHE P22303 13/20 0.56
BCHE P06276 14/20 0.52
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 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
SCHEMBL8870095 0.87 ACHE (0.61) ACHEBCHELMNA
SCHEMBL1127774 0.81 ACHE (0.85) ACHEBCHE
Bromide SCHEMBL3601825 0.79 ACHE (0.89) ACHEBCHE
Hydrochloric Acid SCHEMBL8870693 0.79 ACHE (0.81) ACHEBCHELMNA
SCHEMBL7929654 0.77 TP53 (0.39)
SCHEMBL21750919 0.76 NPSR1 (0.40) LMNA
SCHEMBL21750997 0.76 ACHE (0.52) ACHEBCHE
SCHEMBL8002272 0.75 TP53 (0.37)
SCHEMBL21750989 0.72 KDM4E (0.38) LMNACYP1A2CYP2D6
SCHEMBL21750875 0.71 CHRM2 (0.44) ACHELMNACYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200062783-A1 PHOTO LEWIS ACID GENERATOR NIPPON SHOKUBAI CO., LTD. (JP) 2020-02-27 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-20200062783-A1 PHOTO LEWIS ACID GENERATOR LEO1, LRRK2, LSG1 ACHE 4068/4885BCHE 3567/4885LMNA 675/4885

“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.