SCHEMBL25787014

SCHEMBL25787014

C[SiH2]c1cc(C)c(N)c(C)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
CYP3A4 P08684 3/20 0.52
TSHR P16473 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
TP53 P04637 2/20 0.52
POLB P06746 1/20 0.44
MAPK1 P28482 1/20 0.39
CD44 P16070 1/20 0.35
KDM4E B2RXH2 2/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
THRB P10828 1/20 0.31
ALOX15 P16050 1/20 0.31
SMN1; SMN2 Q16637 1/20 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
SCHEMBL559133 0.71
SCHEMBL9669 0.69 ALDH1A1 (1.00) ALDH1A1CYP3A4TSHRTDP1TP53
SCHEMBL1866504 0.69 ALDH1A1 (1.00) ALDH1A1CYP3A4TSHRTDP1TP53
SCHEMBL139002 0.69 ALDH1A1 (0.65) ALDH1A1CYP3A4TSHRTDP1TP53
SCHEMBL33589 0.69 ALDH1A1 (0.65) ALDH1A1CYP3A4TSHRTDP1TP53
SCHEMBL3210027 0.69 ALDH1A1 (0.55) ALDH1A1CYP3A4TSHRTDP1TP53
SCHEMBL24512194 0.69 ALDH1A1 (0.60) ALDH1A1CYP3A4TSHRMAPK1KDM4E
Methane SCHEMBL2038793 0.67 ALDH1A1 (0.61) ALDH1A1CYP3A4TSHRTDP1TP53
Ammonia Solution, Strong SCHEMBL7696025 0.67 ALDH1A1 (0.93) ALDH1A1CYP3A4TSHRTDP1TP53
SCHEMBL4540248 0.67 ALDH1A1 (0.93) ALDH1A1CYP3A4TSHRTDP1TP53

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-20230212125-A1 COMPOUND AS POTASSIUM CHANNEL REGULATOR AND PREPARATION AND USE THEREOF SHANGHAI ZHIMENG BIOPHARMA, INC. (CN) 2023-07-06 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-20230212125-A1 COMPOUND AS POTASSIUM CHANNEL REGULATOR AND PREPARATION AND USE THEREOF KCNQ2, KCNQ1, KCNQ5 ALDH1A1 3791/4885CYP3A4 716/4885TSHR 1648/4885

“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.