SCHEMBL21608474

SCHEMBL21608474

COC(C)c1ncc(NC(=O)OC(C)(C)C)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 8/20 0.44
KMT2A Q03164 1/20 0.41
RORC P51449 1/20 0.40
ATR Q13535 1/20 0.40
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK1 P28482 1/20 0.39
MAPKAPK2 P49137 3/20 0.39
S1PR3 Q99500 1/20 0.38
TRPA1 O75762 1/20 0.38

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
SCHEMBL21598682 0.83 RORC (0.47) MALT1KMT2ARORCLMNASMN1; SMN2
SCHEMBL31423753 0.82 MAPKAPK2 (0.41) RORCATRMAPK1MAPKAPK2S1PR3
SCHEMBL1010435 0.80 ATR (0.46) RORCATRMAPKAPK2TRPA1
SCHEMBL23510800 0.78 ALDH1A1 (0.44) KMT2ARORCATRSMN1; SMN2MAPK1
SCHEMBL6491966 0.78 MAPKAPK2 (0.47) RORCATRMAPKAPK2S1PR3
SCHEMBL18839612 0.76 MAPKAPK2 (0.41) RORCATRMAPKAPK2
SCHEMBL29813513 0.75 ATF1 (0.42) RORCATRMAPKAPK2
SCHEMBL29813512 0.75 ATF1 (0.42) RORCATRMAPKAPK2
SCHEMBL23147986 0.75 ATF1 (0.42) RORCATRMAPKAPK2
SCHEMBL25397341 0.74 MAPKAPK2 (0.36) RORCATRMAPKAPK2S1PR3

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
CN-112601747-B Pyrazole derivatives as MALT1 inhibitors 詹森药业有限公司 2023-02-21 CN disclosed
US-10888550-B2 Pyrazole derivatives as MALT1 inhibitors JANSSEN PHARMACEUTICA NV (BE) 2021-01-12 US disclosed
WO-2019243965-A1 PYRAZOLE DERIVATIVES AS MALT1 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2019-12-26 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-10888550-B2 Pyrazole derivatives as MALT1 inhibitors MALT1, PPP3R1, SQSTM1 MALT1 1/4885KMT2A 3576/4885RORC 1645/4885

“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.