SCHEMBL29326016

SCHEMBL29326016

Cc1nc(N[C@@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)nnc1Cl

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
SYK P43405 8/20 0.41
BTK Q06187 2/20 0.36
JAK3 P52333 1/20 0.36
GAA P10253 1/20 0.34
CCR1 P32246 1/20 0.34
EPHX1 P07099 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
TAS1R2 Q8TE23 1/20 0.34
ACACB O00763 1/20 0.34
ACACA Q13085 1/20 0.34
KDM1A O60341 1/20 0.33
PTPN11 Q06124 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
SCHEMBL29326172 0.80 SYK (0.39) HDAC4HDAC6SYKCCR1TAS1R3
SCHEMBL29326175 0.77 SYK (0.40) HDAC4HDAC6SYKGAA
SCHEMBL6922118 0.77 MCHR1 (0.43) HDAC4HDAC6SYKBTKGAA
SCHEMBL12885089 0.76 BTK (0.53) HDAC4HDAC6BTKGAAEPHX1
SCHEMBL19773841 0.76 BTK (0.53) HDAC4HDAC6BTKGAAEPHX1
SCHEMBL765253 0.76 BTK (0.53) HDAC4HDAC6BTKGAAEPHX1
SCHEMBL29155930 0.75 IDH1 (0.45) SYKPTPN11
SCHEMBL29325890 0.75 IDH1 (0.45) SYKPTPN11
SCHEMBL29325892 0.75 IDH1 (0.45) SYKPTPN11
SCHEMBL31341803 0.75 IDH1 (0.45) SYKPTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239758-A1 SUBSTITUTED TRIAZINE COMPOUND NICO THERAPEUTICS, INC. 2024-07-18 US disclosed
US-20240239758-A1 SUBSTITUTED TRIAZINE COMPOUND NICO THERAPEUTICS, INC. 2024-07-18 US disclosed
EP-4345097-A1 SUBSTITUTED TRIAZINE COMPOUND Astellas Pharma Inc. (JP) 2024-04-03 EP disclosed
WO-2022230912-A1 SUBSTITUTED TRIAZINE COMPOUND アステラス製薬株式会社 2022-11-03 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-20240239758-A1 SUBSTITUTED TRIAZINE COMPOUND NLRP3, NLRP1, PYCARD HDAC4 411/4885HDAC6 393/4885SYK 813/4885

“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.