SCHEMBL29418486

SCHEMBL29418486

Cc1c(CNC(=O)c2nc(C(C)(C)C)no2)ccc(-c2ccncc2N2CCCC(N(C)C(=O)OC(C)(C)C)C2)c1F

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 13/20 0.42
▸ LCK P06239 1/20 0.40
▸ PIK3CD O00329 1/20 0.36
▸ KIF18A Q8NI77 1/20 0.35
▸ KDM4D Q6B0I6 1/20 0.34
▸ ATR Q13535 1/20 0.33
▸ RET P07949 1/20 0.33
▸ AAK1 Q2M2I8 1/20 0.32
▸ PDE10A Q9Y233 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
SCHEMBL29418564 1.00 BTK (0.42) BTKLCKPIK3CDKIF18AKDM4D
SCHEMBL25214645 0.92 BTK (0.42) BTKLCKATR
SCHEMBL29418416 0.90 BTK (0.41) BTKLCKATR
SCHEMBL25224087 0.90 BTK (0.41) BTKLCKATR
SCHEMBL29418749 0.89 BTK (0.44) BTKLCKPIK3CDKIF18AKDM4D
SCHEMBL29418487 0.89 BTK (0.44) BTKLCKPIK3CDKIF18AKDM4D
SCHEMBL29418421 0.88 BTK (0.41) BTKLCKPIK3CDKIF18AKDM4D
Hydrochloric Acid SCHEMBL25224200 0.84 BTK (0.43) BTKLCK
Hydrochloric Acid SCHEMBL29418328 0.84 BTK (0.43) BTKLCK
SCHEMBL29124731 0.82 BTK (0.42) BTKLCK

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
US-20240327380-A1 BTK INHIBITORS BIOGEN MA INC. (US) 2024-10-03 — — US disclosed
EP-4192587-A1 BTK INHIBITORS Biogen MA Inc. (US) 2023-06-14 — — EP disclosed
WO-2022032019-A1 BTK INHIBITORS BIOGEN MA INC. (US) 2022-02-10 — — 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-20240327380-A1 BTK INHIBITORS BTK, SYK, LYN BTK 1/4885LCK 7/4885PIK3CD 80/4885

“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.

Send feedback