SCHEMBL29438003

SCHEMBL29438003

CC[C@H]1NC(=O)N(c2ccc(Oc3ccc(C#N)cc3C3CC3)nc2)C1=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.38
HSD11B1 P28845 2/20 0.34
ELANE P08246 2/20 0.34
NR3C1 P04150 3/20 0.33
ROCK2 O75116 1/20 0.33
CYP11B2 P19099 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
PDE5A O76074 2/20 0.32
AR P10275 1/20 0.32
KCNH2 Q12809 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
ICMT O60725 1/20 0.32
HSD11B2 P80365 1/20 0.32

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
SCHEMBL1978997 1.00 PTGDR2 (0.38) PTGDR2HSD11B1ELANENR3C1ROCK2
SCHEMBL1978597 0.88 OXTR (0.36) HSD11B1ELANEAR
SCHEMBL29437994 0.85 ELANE (0.33) HSD11B1ELANEROCK2
SCHEMBL1979583 0.85 ELANE (0.33) HSD11B1ELANEROCK2
SCHEMBL18952958 0.83 KDM4E (0.33) HSD11B1ELANEARKCNH2HRH3
SCHEMBL1980470 0.83 SLC22A12 (0.36) HRH3GPR119
SCHEMBL30939607 0.83 SLC22A12 (0.36) HRH3GPR119
SCHEMBL1979096 0.81 HSD11B1 (0.38) PTGDR2HSD11B1ELANECYP11B2EGLN1
SCHEMBL21116569 0.81 PTGDR2 (0.39) PTGDR2HSD11B1ELANENR3C1CYP11B2
SCHEMBL30939616 0.81 HSD11B1 (0.38) PTGDR2HSD11B1ELANECYP11B2EGLN1

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
CN-118267386-A Modulators of KV3 channels for the treatment of pain 奥提芙尼治疗学有限公司 2024-07-02 CN disclosed
CN-108472288-B Modulators of KV3 channels for the treatment of pain 奥提芙尼治疗学有限公司 2024-05-28 CN disclosed
US-11583527-B2 Hydantoin derivatives useful as Kv3 inhibitors AUTIFONY THERAPEUTICS LIMITED (GB) 2023-02-21 US disclosed
US-20220054490-A1 HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS AUTIFONY THERAPEUTICS LIMITED (GB) 2022-02-24 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 (2 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-11583527-B2 Hydantoin derivatives useful as Kv3 inhibitors KCNN3, KCND3, KCNA3 PTGDR2 1454/4885HSD11B1 3743/4885ELANE 3778/4885
US-20220054490-A1 HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS KCNN3, KCND3, KCNA3 PTGDR2 1454/4885HSD11B1 3743/4885ELANE 3778/4885

“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.