SCHEMBL30213864

SCHEMBL30213864

Oc1cc(C(F)(F)F)ccc1-c1nnc(N[C@@H]2CCCCNC2)c2cnccc12

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IL1B P01584 5/20 0.49
CHEK2 O96017 2/20 0.48
CHEK1 O14757 2/20 0.48
NLRP3 Q96P20 4/20 0.48
KCNH2 Q12809 1/20 0.48
PRKCZ Q05513 8/20 0.44
PRKD2 Q9BZL6 2/20 0.43
LATS1 O95835 1/20 0.42
LATS2 Q9NRM7 1/20 0.42

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
SCHEMBL29275723 1.00 IL1B (0.49) IL1BCHEK2CHEK1NLRP3KCNH2
SCHEMBL29276000 0.97 IL1B (0.51) IL1BCHEK2CHEK1NLRP3KCNH2
SCHEMBL30214375 0.97 IL1B (0.51) IL1BCHEK2CHEK1NLRP3KCNH2
Hydrochloric Acid SCHEMBL30214836 0.96 IL1B (0.50) IL1BCHEK2CHEK1NLRP3KCNH2
Hydrochloric Acid SCHEMBL29276166 0.96 IL1B (0.50) IL1BCHEK2CHEK1NLRP3KCNH2
Formic Acid SCHEMBL30994511 0.96 IL1B (0.46) IL1BCHEK2CHEK1NLRP3KCNH2
Formic Acid SCHEMBL29275602 0.96 IL1B (0.46) IL1BCHEK2CHEK1NLRP3KCNH2
SCHEMBL30624999 0.94 IL1B (0.51) IL1BCHEK2CHEK1NLRP3KCNH2
Formic Acid SCHEMBL30214139 0.93 IL1B (0.47) IL1BCHEK2CHEK1NLRP3KCNH2
SCHEMBL31043271 0.91 IL1B (0.56) IL1BCHEK2CHEK1NLRP3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240262806-A1 INHIBITORS OF NLRP3 PCT THERAPEUTICS, INC. (US) 2024-08-08 US claimed
CN-118302417-A NLRP3 inhibitors PTC医疗公司 2024-07-05 CN claimed
EP-4392414-A1 INHIBITORS OF NLRP3 PTC Therapeutics, Inc. (US) 2024-07-03 EP claimed
WO-2023028534-A1 INHIBITORS OF NLRP3 PTC THERAPEUTICS, INC. (US) 2023-03-02 WO claimed
US-20240262806-A1 INHIBITORS OF NLRP3 PCT THERAPEUTICS, INC. (US) 2024-08-08 US disclosed
CN-118302417-A NLRP3 inhibitors PTC医疗公司 2024-07-05 CN 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-20240262806-A1 INHIBITORS OF NLRP3 NLRP3, NOD1, NLRP1 IL1B 10/4885CHEK2 4518/4885CHEK1 4276/4885

“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.