SCHEMBL22925072

SCHEMBL22925072

CC(C)/N=C/c1c[nH]c2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.62
HPGD P15428 1/20 0.62
PTGS2 P35354 2/20 0.56
MAPT P10636 7/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
LMNA P02545 1/20 0.55
POLB P06746 1/20 0.55
SENP7 Q9BQF6 5/20 0.54
CYP2A6 P11509 1/20 0.53
IMPDH2 P12268 1/20 0.53
HSP90AA1 P07900 1/20 0.53
SENP8 Q96LD8 3/20 0.52
SENP6 Q9GZR1 3/20 0.52
CASP3 P42574 2/20 0.52
ALDH1A1 P00352 3/20 0.51
GAA P10253 3/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CYP1A2 P05177 1/20 0.50

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
SCHEMBL3349880 0.80 HTT (0.72) HTTHPGDPTGS2MAPTMEN1
SCHEMBL15930268 0.80 HTT (0.72) HTTHPGDPTGS2MAPTMEN1
SCHEMBL1643902 0.77 HTT (0.68) HTTHPGDPTGS2MAPTMEN1
SCHEMBL2189141 0.77 HTT (1.00) HTTHPGDPTGS2MAPTMEN1
SCHEMBL1643903 0.77 HTT (0.68) HTTHPGDPTGS2MAPTMEN1
SCHEMBL2189137 0.77 HTT (1.00) HTTHPGDPTGS2MAPTMEN1
SCHEMBL13622497 0.77 HTT (0.68) HTTHPGDPTGS2MAPTMEN1
SCHEMBL5167169 0.77 HTT (1.00) HTTHPGDPTGS2MAPTMEN1
SCHEMBL31355128 0.77 HTT (1.00) HTTHPGDPTGS2MAPTMEN1
SCHEMBL29786168 0.77 HTT (0.68) HTTHPGDPTGS2MAPTMEN1

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
US-11066410-B2 Fused triazolo-pyrimidine compounds having useful pharmaceutical application 3100 CENTRAL EXPRESSWAY LLC (US) 2021-07-20 US disclosed
WO-2021012264-A1 TRIAZOLE SULFONAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 东莞市东阳光农药研发有限公司 2021-01-28 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-11066410-B2 Fused triazolo-pyrimidine compounds having useful pharmaceutical application PIKFYVE, PIP4K2B, PIP4K2A HTT 2855/4885HPGD 4401/4885PTGS2 4363/4885

“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.