SCHEMBL18843035

SCHEMBL18843035

Nc1nccc2c1n(-c1ccccc1)c(=O)n2[C@@H]1CCCNC1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.58
▸ EGFR P00533 1/20 0.51
▸ TEC P42680 1/20 0.51
▸ CD69 Q07108 1/20 0.51

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
SCHEMBL29737150 0.91 BTK (0.71) BTKEGFRTECCD69
SCHEMBL18285546 0.91 BTK (0.71) BTKEGFRTECCD69
SCHEMBL30970923 0.91 BTK (0.71) BTKEGFRTECCD69
SCHEMBL18285696 0.91 BTK (0.71) BTKEGFRTECCD69
Oxalic Acid SCHEMBL31683711 0.87 BTK (0.66) BTKEGFRTECCD69
SCHEMBL28830810 0.86 BTK (0.62) BTKEGFRTECCD69
SCHEMBL18285475 0.83 BTK (0.59) BTKEGFRTECCD69
SCHEMBL28076744 0.83 BTK (0.59) BTKEGFRTECCD69
SCHEMBL24832588 0.78 BTK (0.47) BTKEGFRTECCD69
SCHEMBL24590413 0.76 BTK (0.60) BTKEGFRTECCD69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230151012-A1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2023-05-18 — — US disclosed
US-20180162861-A1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2018-06-14 — — US disclosed
US-20180162861-A1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2018-06-14 — — US disclosed
US-9688676-B2 Tyrosine kinase inhibitors PRINCIPIA BIOPHARMA INC. (US) 2017-06-27 — — US disclosed
US-9688676-B2 Tyrosine kinase inhibitors PRINCIPIA BIOPHARMA INC. (US) 2017-06-27 — — US disclosed
US-20170129890-A1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2017-05-11 — — US disclosed
US-20170129890-A1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2017-05-11 — — 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 (3 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-20180162861-A1 TYROSINE KINASE INHIBITORS BTK, LYN, SYK BTK 1/4885EGFR 237/4885TEC 12/4885
US-20170129890-A1 TYROSINE KINASE INHIBITORS BTK, LYN, SYK BTK 1/4885EGFR 237/4885TEC 12/4885
US-20230151012-A1 TYROSINE KINASE INHIBITORS BTK, LYN, SYK BTK 1/4885EGFR 237/4885TEC 12/4885

“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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