SCHEMBL22650747

SCHEMBL22650747

CC(C)n1cnc2c(F)nc(B(O)O)cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
CDK1 P06493 2/20 0.35
CCNB1 P14635 2/20 0.35
CCNE1 P24864 2/20 0.35
CDK2 P24941 2/20 0.35
HCAR3 P49019 1/20 0.35
L3MBTL1 Q9Y468 6/20 0.34
APAF1 O14727 4/20 0.33
CDK5 Q00535 2/20 0.33
CDK5R1 Q15078 2/20 0.33
NPC1 O15118 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
ADORA1 P30542 1/20 0.33
PI4KA P42356 1/20 0.33
PI4K2B Q8TCG2 1/20 0.33
PI4K2A Q9BTU6 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
HTR3A P46098 3/20 0.32
MAPK14 Q16539 2/20 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
SCHEMBL29491151 1.00 SMN1; SMN2 (0.42) SMN1; SMN2CDK1CCNB1CCNE1CDK2
SCHEMBL29491171 0.77 SMN1; SMN2 (0.45) SMN1; SMN2CDK1CCNB1CCNE1CDK2
SCHEMBL22650746 0.77 SMN1; SMN2 (0.45) SMN1; SMN2CDK1CCNB1CCNE1CDK2
SCHEMBL22650373 0.71 SMN1; SMN2 (0.39) SMN1; SMN2CDK1CCNB1CCNE1CDK2
SCHEMBL22650600 0.68 MAPK14 (0.40) SMN1; SMN2CDK1CDK2L3MBTL1APAF1
SCHEMBL29491131 0.68 MAPK14 (0.40) SMN1; SMN2CDK1CDK2L3MBTL1APAF1
SCHEMBL22650372 0.67 SMN1; SMN2 (0.36) SMN1; SMN2CDK2CDK5CDK5R1HTR3A
SCHEMBL22650364 0.67 CDK4 (0.37) SMN1; SMN2CDK2CDK5CDK5R1HTR3A
SCHEMBL19397176 0.67 SMN1; SMN2 (0.51) SMN1; SMN2CDK1CCNB1CCNE1CDK2
SCHEMBL20600683 0.66 SMN1; SMN2 (0.46) SMN1; SMN2CDK1CCNB1CCNE1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250325544-A1 CDK INHIBITORS GENENTECH, INC. (US) 2025-10-23 US disclosed
US-20250275971-A1 CDK INHIBITORS GENENTECH, INC. (US) 2025-09-04 US disclosed
US-12285429-B2 CDK inhibitors GENENTECH, INC. (US) 2025-04-29 US disclosed
US-20240066031-A1 CDK INHIBITORS GENENTECH, INC. 2024-02-29 US disclosed
US-20240066031-A1 CDK INHIBITORS GENENTECH, INC. 2024-02-29 US disclosed
US-20240066031-A1 CDK INHIBITORS GENENTECH, INC. 2024-02-29 US disclosed
US-20240033264-A1 CDK INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2024-02-01 US disclosed
US-20230174512-A1 CDK INHIBITORS GENENTECH, INC. 2023-06-08 US disclosed
US-20230174512-A1 CDK INHIBITORS GENENTECH, INC. 2023-06-08 US disclosed
US-20230174512-A1 CDK INHIBITORS GENENTECH, INC. 2023-06-08 US disclosed
US-20220296595-A1 CDK INHIBITORS GENENTECH, INC. 2022-09-22 US disclosed
WO-2020224568-A1 CDK INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2020-11-12 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 (7 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-20240033264-A1 CDK INHIBITORS CDK9, CDKL1, CDK3 SMN1; SMN2 2631/4885CDK1 5/4885CCNB1 39/4885
US-20240066031-A1 CDK INHIBITORS CDK9, CDKL1, CDK3 SMN1; SMN2 2631/4885CDK1 5/4885CCNB1 39/4885
US-12285429-B2 CDK inhibitors CDK9, CDK3, CDKL1 SMN1; SMN2 2470/4885CDK1 5/4885CCNB1 40/4885
US-20250325544-A1 CDK INHIBITORS CDK6, CDK9, CDKL1 SMN1; SMN2 2041/4885CDK1 4/4885CCNB1 45/4885
US-20220296595-A1 CDK INHIBITORS CDKL1, CDK9, CDK6 SMN1; SMN2 2350/4885CDK1 7/4885CCNB1 42/4885
US-20230174512-A1 CDK INHIBITORS CDK9, CDKL1, CDK3 SMN1; SMN2 2631/4885CDK1 5/4885CCNB1 39/4885
US-20250275971-A1 CDK INHIBITORS CDK6, CDK9, CDKL1 SMN1; SMN2 2041/4885CDK1 4/4885CCNB1 45/4885

“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.