SCHEMBL30749022

SCHEMBL30749022

[2H]C([2H])([2H])Nc1nc(CO)nc2c1C(C)(C)C(=O)N2c1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.34
BTK Q06187 1/20 0.33
KCNH2 Q12809 1/20 0.33
TRPV1 Q8NER1 1/20 0.32
KIF18A Q8NI77 1/20 0.32
SYK P43405 2/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
SMO Q99835 2/20 0.31
PGR P06401 1/20 0.31
GPR183 P32249 1/20 0.31
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
ADRA1A P35348 1/20 0.31
JAK2 O60674 1/20 0.30
WNT3A P56704 1/20 0.30

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
SCHEMBL30748735 0.94 AOC3 (0.36) AOC3BTKKCNH2TRPV1KIF18A
SCHEMBL30748728 0.89 BTK (0.35) AOC3BTKKCNH2TRPV1KIF18A
SCHEMBL31691211 0.87 AOC3 (0.32) AOC3BTKKCNH2KIF18A
SCHEMBL30748781 0.86 AOC3 (0.39) AOC3BTKKCNH2TRPV1KIF18A
SCHEMBL30748916 0.85 HDAC6 (0.34) AOC3KCNH2TRPV1SYKMAPT
SCHEMBL30749040 0.83 TRPV1 (0.38) BTKKCNH2TRPV1SYKMAPT
SCHEMBL31691294 0.81 WDR5 (0.30)
SCHEMBL31691334 0.78 HDAC6 (0.34) AOC3TRPV1SYKMAPTRAB9A
SCHEMBL30748902 0.78 TRPV3 (0.35) SYKADRA1A
SCHEMBL30748800 0.77 AOC3 (0.38) AOC3BTKKCNH2TRPV1KIF18A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250304571-A1 BIOLOGICALLY ACTIVE COMPOUNDS AND METHODS THEREOF SUZHOU KEEN THERAPEUTICS CO., LTD. (CN) 2025-10-02 US disclosed
EP-4565588-A1 BIOLOGICALLY ACTIVE COMPOUNDS AND METHODS THEREOF Suzhou Keen Therapeutics Co., Ltd. (CN) 2025-06-11 EP disclosed
WO-2023241620-A1 BIOLOGICALLY ACTIVE COMPOUNDS AND METHODS THEREOF SUZHOU KEEN THERAPEUTICS CO., LTD. (CN) 2023-12-21 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-20250304571-A1 BIOLOGICALLY ACTIVE COMPOUNDS AND METHODS THEREOF VHL, BRCA1, TERT AOC3 3013/4885BTK 1727/4885KCNH2 4554/4885

“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.