SCHEMBL20512302

SCHEMBL20512302

CCOC(C#Cc1cnc(Cl)nc1NC(CNC(=O)OC(C)(C)C)C(C)CC)OCC

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
STK17B O94768 1/20 0.41
STK17A Q9UEE5 1/20 0.41
AAK1 Q2M2I8 1/20 0.32
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31
SYK P43405 1/20 0.30
PCSK9 Q8NBP7 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
SCHEMBL2726114 1.00 STK17B (0.41) STK17BSTK17AAAK1CTSSCTSK
SCHEMBL15238303 1.00 STK17B (0.41) STK17BSTK17AAAK1CTSSCTSK
SCHEMBL18494391 1.00 STK17B (0.41) STK17BSTK17AAAK1CTSSCTSK
SCHEMBL15724549 0.89 STK17B (0.44) STK17BSTK17AAAK1SYKPCSK9
SCHEMBL21967068 0.88
SCHEMBL21967069 0.88
SCHEMBL2723400 0.87 STK17B (0.43) STK17BSTK17AAAK1SYK
SCHEMBL18495143 0.87 STK17B (0.43) STK17BSTK17AAAK1SYK
SCHEMBL15238242 0.87 STK17B (0.43) STK17BSTK17AAAK1SYK
SCHEMBL15249218 0.86 STK17B (0.43) STK17BSTK17AAAK1CTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108283644-B Transient protection of normal cells during chemotherapy G1治疗公司 2022-03-18 CN disclosed
CN-108434149-B HSPC-sparing therapy for Rb-positive abnormal cell proliferation G1治疗公司 2021-05-28 CN disclosed
CN-107417691-B Highly effective anti-neoplastic and anti-proliferative agents G1治疗公司 2020-06-26 CN disclosed
EP-3653209-A1 TRANSIENT PROTECTION OF NORMAL CELLS DURING CHEMOTHERAPY G1 Therapeutics, Inc. (US) 2020-05-20 EP disclosed
US-10189851-B2 CDK inhibitors G1 THERAPEUTICS, INC. (US) 2019-01-29 US disclosed
US-10189850-B2 CDK inhibitors G1 THERAPEUTICS, INC. (US) 2019-01-29 US disclosed
US-20180360841-A1 HSPC-SPARING TREATMENTS FOR RB-POSITIVE ABNORMAL CELLULAR PROLIFERATION G1 THERAPEUTICS, INC. (US) 2018-12-20 US disclosed
EP-3381920-A1 CDK INHIBITORS G1 Therapeutics, Inc. (US) 2018-10-03 EP 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-10189851-B2 CDK inhibitors CDK3, CDK9, CDK6 STK17B 149/4885STK17A 152/4885AAK1 951/4885
US-20180360841-A1 HSPC-SPARING TREATMENTS FOR RB-POSITIVE ABNORMAL CELLULAR PROLIFERATION RB1, CDK4, CDKN1A STK17B 986/4885STK17A 957/4885AAK1 1704/4885
US-10189850-B2 CDK inhibitors CDK3, CDK9, CDK6 STK17B 149/4885STK17A 152/4885AAK1 951/4885

“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.