SCHEMBL27156701

SCHEMBL27156701

CC(=O)N1CC[C@H]1Cn1ncc2cnc(Cl)nc21

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ IL1B P01584 1/20 0.33
▸ P2RX7 Q99572 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.31
▸ AURKA O14965 1/20 0.31
▸ CDK1 P06493 1/20 0.31
▸ AURKB Q96GD4 1/20 0.31
▸ MDM4 O15151 1/20 0.30
▸ MDM2 Q00987 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
SCHEMBL29819745 1.00 IL1B (0.33) IL1BP2RX7LRRK2AURKACDK1
SCHEMBL27156706 1.00 IL1B (0.33) IL1BP2RX7LRRK2AURKACDK1
SCHEMBL27156880 0.93 AURKA (0.37) AURKACDK1AURKBMDM4MDM2
SCHEMBL27156527 0.93 AURKA (0.37) AURKACDK1AURKBMDM4MDM2
SCHEMBL27156392 0.92 AURKA (0.36) AURKACDK1AURKBMDM4MDM2
SCHEMBL29819718 0.92 AURKA (0.36) AURKACDK1AURKBMDM4MDM2
SCHEMBL27156644 0.92 AURKA (0.36) AURKACDK1AURKBMDM4MDM2
SCHEMBL27156388 0.92 AURKA (0.36) AURKACDK1AURKBMDM4MDM2
SCHEMBL29819920 0.92 AURKA (0.36) AURKACDK1AURKBMDM4MDM2
SCHEMBL27156740 0.89 KMO (0.30) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11918582-B2 Pyrazole pyrimidine compounds and uses thereof RAPT THERAPEUTICS, INC. (US) 2024-03-05 — — US disclosed
US-20220305018-A1 PYRAZOLE PYRIMIDINE COMPOUNDS AND USES THEREOF RAPT THERAPEUTICS, INC. 2022-09-29 — — 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-11918582-B2 Pyrazole pyrimidine compounds and uses thereof DCK, MCL1, DTYMK IL1B 3067/4885P2RX7 1357/4885LRRK2 2451/4885
US-20220305018-A1 PYRAZOLE PYRIMIDINE COMPOUNDS AND USES THEREOF DCK, MCL1, DTYMK IL1B 3067/4885P2RX7 1357/4885LRRK2 2451/4885

“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.

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