SCHEMBL22650740

SCHEMBL22650740

CC(C)c1cnn2ccc(-c3nc(Cl)ncc3F)cc12

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RPS6KA5 O75582 1/20 0.32
JAK2 O60674 1/20 0.32
MAPK8 P45983 2/20 0.32
GSK3B P49841 2/20 0.32
CAMKK2 Q96RR4 2/20 0.32
PIK3CG P48736 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL22650436 0.81 RPS6KA5 (0.34) RPS6KA5SMN1; SMN2
SCHEMBL22650356 0.81 SCN5A (0.39) RPS6KA5JAK2SMN1; SMN2
SCHEMBL22650387 0.79 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL22650365 0.78 DYRK1A (0.36) JAK2GSK3BSMN1; SMN2
SCHEMBL20356475 0.77 RPS6KA5 (0.35) RPS6KA5SMN1; SMN2
SCHEMBL22650908 0.77 CAMKK1 (0.38) RPS6KA5CAMKK2
SCHEMBL22650388 0.76 MAPK8 (0.32) MAPK8GSK3BCAMKK2PIK3CG
SCHEMBL22650482 0.75 CDK1 (0.59) JAK2GSK3B
SCHEMBL22650852 0.75 CDK2 (0.59)
SCHEMBL22650437 0.74 SCN5A (0.42) RPS6KA5SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120040446-A CDK inhibitors 基因泰克公司 2025-05-27 CN 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-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
EP-3966213-A1 CDK INHIBITORS Qilu Regor Therapeutics Inc. (CN) 2022-03-16 EP disclosed
WO-2021226140-A1 CDK INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2021-11-11 WO 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 (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-20240066031-A1 CDK INHIBITORS CDK9, CDKL1, CDK3 RPS6KA5 367/4885JAK2 253/4885MAPK8 256/4885
US-20220296595-A1 CDK INHIBITORS CDKL1, CDK9, CDK6 RPS6KA5 342/4885JAK2 487/4885MAPK8 192/4885
US-20230174512-A1 CDK INHIBITORS CDK9, CDKL1, CDK3 RPS6KA5 367/4885JAK2 253/4885MAPK8 256/4885

“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.