SCHEMBL22947696

SCHEMBL22947696

Clc1ccccc1-c1ccc2c(c1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-2

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.46
PDK2 Q15119 1/20 0.39
BACE1 P56817 1/20 0.38
TRPA1 O75762 1/20 0.38
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
TYK2 P29597 1/20 0.37
JAK3 P52333 1/20 0.37
AR P10275 1/20 0.36
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
MAOB P27338 2/20 0.36
TNKS2 Q9H2K2 1/20 0.35
FFAR1 O14842 1/20 0.34
PGR P06401 3/20 0.33
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
DHODH Q02127 1/20 0.33
ABL1 P00519 1/20 0.33

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
SCHEMBL22947483 0.89 TNKS2 (0.39) CYP2A6PDK2BACE1TRPA1JAK2
SCHEMBL22947702 0.87 CYP1A2 (0.38) CYP2A6PDK2BACE1TRPA1JAK2
SCHEMBL22947621 0.86 BACE1 (0.41) CYP2A6PDK2BACE1TRPA1JAK2
SCHEMBL15975773 0.86 MEN1 (0.37) PDK2MAOB
SCHEMBL27394634 0.85 ESR1 (0.33) CYP2A6EDNRBEDNRA
SCHEMBL23177511 0.84 CYP2A6 (0.35) CYP2A6PDK2BACE1TRPA1JAK2
SCHEMBL22572809 0.84 CYP1A2 (0.44) PDK2EDNRBEDNRA
SCHEMBL30601306 0.82 CNR2 (0.38) CYP2A6JAK2JAK1TYK2JAK3
SCHEMBL26626391 0.82 CNR2 (0.38) CYP2A6JAK2JAK1TYK2JAK3
SCHEMBL22947476 0.81 CYP2A6 (0.43) CYP2A6PDK2BACE1TRPA1JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024096578-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE HAVING SAME 덕산네오룩스 주식회사 2024-05-10 WO disclosed
US-20210036245-A1 HETEROAROMATIC COMPOUNDS MERCK PATENT GMBH (DE) 2021-02-04 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-20210036245-A1 HETEROAROMATIC COMPOUNDS ETV6, FES, LEF1 CYP2A6 1117/4885PDK2 1353/4885BACE1 2983/4885

“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.