SCHEMBL23125461

SCHEMBL23125461

CC(C)C(C)(C)OB(O)c1ccnc(Cl)c1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.33
AAK1 Q2M2I8 7/20 0.32
PREP P48147 1/20 0.32
FAP Q12884 1/20 0.32
LOX P28300 1/20 0.30
LOXL3 P58215 1/20 0.30
LOXL2 Q9Y4K0 1/20 0.30
MKNK1 Q9BUB5 1/20 0.30
BMP2K Q9NSY1 1/20 0.30
LMNA P02545 1/20 0.30
KMT2A Q03164 1/20 0.30
SMARCA2 P51531 1/20 0.30
SMARCA4 P51532 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
SCHEMBL16012071 0.81 RECQL (0.34) RECQLLOXLOXL3LOXL2SMARCA2
SCHEMBL5952636 0.71 TRPV6 (0.38) LMNA
SCHEMBL5952228 0.70 CA1 (0.49) KMT2A
SCHEMBL200588 0.69 RECQL (0.47) RECQLLOXLOXL3LOXL2SMARCA2
SCHEMBL29717267 0.69 RECQL (0.47) RECQLLOXLOXL3LOXL2SMARCA2
SCHEMBL5952711 0.69 CA2 (0.43) KMT2A
SCHEMBL5953307 0.69
SCHEMBL5951160 0.68 CYP1A2 (0.33) KMT2A
SCHEMBL16008776 0.67 CHRNA7 (0.30)
SCHEMBL5952628 0.66 ORAI1 (0.34)

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-10952999-B2 Inhibitor of cyclin-dependent kinase CDK9 GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2021-03-23 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-10952999-B2 Inhibitor of cyclin-dependent kinase CDK9 CDK9, CDK19, CDK1 RECQL 1254/4885AAK1 415/4885PREP 752/4885

“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.