SCHEMBL30306526

SCHEMBL30306526

Cc1cnc(Nc2ccc(N3CCN(C)CC3)cc2)nc1Nc1cccc(S(=O)(=O)NC2CC2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 1.00
JAK2 O60674 2/20 0.77
JAK1 P23458 2/20 0.77
BRD2 P25440 2/20 0.77
JAK3 P52333 2/20 0.77
BRD3 Q15059 2/20 0.77
BRDT Q58F21 2/20 0.77
BUB1B O60566 1/20 0.77
RET P07949 1/20 0.77
WEE1 P30291 1/20 0.77
FLT3 P36888 1/20 0.77
ALK Q9UM73 1/20 0.77

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
SCHEMBL17526142 1.00 BRD4 (1.00) BRD4JAK2JAK1BRD2JAK3
SCHEMBL31163098 0.97 BRD4 (0.94) BRD4JAK2JAK1BRD2JAK3
SCHEMBL31163088 0.97 BRD4 (0.94) BRD4JAK2JAK1BRD2JAK3
SCHEMBL265921 0.97 BRD4 (0.94) BRD4JAK2JAK1BRD2JAK3
Hydrochloric Acid SCHEMBL264758 0.96 BRD4 (0.92) BRD4JAK2JAK1BRD2JAK3
SCHEMBL264965 0.96 BRD4 (0.92) BRD4JAK2JAK1BRD2JAK3
SCHEMBL265805 0.94 BRD4 (0.89) BRD4JAK2JAK1BRD2JAK3
SCHEMBL30306481 0.92 BRD4 (1.00) BRD4JAK2JAK1BRD2JAK3
SCHEMBL17526215 0.92 BRD4 (1.00) BRD4JAK2JAK1BRD2JAK3
SCHEMBL265965 0.90 BRD4 (0.82) BRD4JAK2JAK1BRD2JAK3

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-11643396-B2 BRD4-kinase inhibitors as cancer therapeutics H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2023-05-09 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-11643396-B2 BRD4-kinase inhibitors as cancer therapeutics BRD4, BICRA, BRDT BRD4 1/4885JAK2 181/4885JAK1 859/4885

“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.