SCHEMBL25955381

SCHEMBL25955381

CCOC(C#Cc1cnc(Cl)nc1NC1(CNC(=O)OC(C)(C)C)CCCCCC1)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
P2RX7 Q99572 1/20 0.35
NPFFR1 Q9GZQ6 1/20 0.33
NPFFR2 Q9Y5X5 1/20 0.33
SYK P43405 1/20 0.31
AAK1 Q2M2I8 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
SCHEMBL2723184 1.00 STK17B (0.41) STK17BSTK17AP2RX7NPFFR1NPFFR2
SCHEMBL2724824 0.99 STK17B (0.41) STK17BSTK17AP2RX7NPFFR1NPFFR2
SCHEMBL29437376 0.99 STK17B (0.41) STK17BSTK17AP2RX7NPFFR1NPFFR2
SCHEMBL20926951 0.92 STK17B (0.40) STK17BSTK17ANPFFR1NPFFR2SYK
SCHEMBL21014235 0.90 P2RX7 (0.33) STK17BSTK17AP2RX7NPFFR1NPFFR2
SCHEMBL20980340 0.90 STK17B (0.38) STK17BSTK17ANPFFR1NPFFR2
SCHEMBL20980348 0.90 STK17B (0.38) STK17BSTK17ANPFFR1NPFFR2
SCHEMBL20913363 0.89
SCHEMBL20696694 0.88
SCHEMBL20835356 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11717523-B2 Transient protection of normal cells during chemotherapy G1 THERAPEUTICS, INC. (US) 2023-08-08 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 (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-11717523-B2 Transient protection of normal cells during chemotherapy CDK6, CCNC, MCL1 STK17B 1245/4885STK17A 1696/4885P2RX7 4351/4885

“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.