SCHEMBL25528937

SCHEMBL25528937

CC(C)(C)OC(=O)NC1CCC(c2nc(Br)c(Br)[nH]2)CC1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PBK Q96KB5 1/20 0.45
JAK1 P23458 3/20 0.41
JAK2 O60674 2/20 0.41
TYK2 P29597 1/20 0.41
JAK3 P52333 1/20 0.41
GAA P10253 2/20 0.41
KDM1A O60341 1/20 0.40
MAOB P27338 1/20 0.40
BTK Q06187 2/20 0.39
PARP1 P09874 2/20 0.38
CKS1B P61024 1/20 0.38
SKP1 P63208 1/20 0.38
SKP2 Q13309 1/20 0.38
EPHX2 P34913 1/20 0.38
CTSK P43235 2/20 0.37
DRD2 P14416 2/20 0.36
LIPG Q9Y5X9 1/20 0.36

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
SCHEMBL25519930 1.00 PBK (0.45) PBKJAK1JAK2TYK2JAK3
SCHEMBL25519927 0.79 JAK1 (0.48) PBKJAK1JAK2TYK2JAK3
SCHEMBL28913117 0.79 JAK1 (0.48) PBKJAK1JAK2TYK2JAK3
SCHEMBL21789372 0.74 JAK1 (0.45) PBKJAK1JAK2TYK2JAK3
SCHEMBL28530478 0.74 JAK1 (0.45) PBKJAK1JAK2TYK2JAK3
SCHEMBL3702157 0.74 BTK (0.61) GAAKDM1AMAOBBTKEPHX2
SCHEMBL1406894 0.74 BTK (0.61) GAAKDM1AMAOBBTKEPHX2
SCHEMBL10343938 0.74 BTK (0.61) GAAKDM1AMAOBBTKEPHX2
SCHEMBL3702152 0.74 BTK (0.61) GAAKDM1AMAOBBTKEPHX2
SCHEMBL23108060 0.73 JAK1 (0.47) PBKJAK1JAK2TYK2JAK3

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-20230142274-A1 SUBSTITUTED ARYL COMPOUND NANJING ZAIMING PHARMACEUTICAL CO., LTD. (CN) 2023-05-11 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-20230142274-A1 SUBSTITUTED ARYL COMPOUND RAD51, FANCI, BLM PBK 4612/4885JAK1 2827/4885JAK2 1989/4885

“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.