SCHEMBL21187343

SCHEMBL21187343

COc1ccc(COc2cc(F)cc3ncn(C)c(=O)c23)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 7/20 0.43
CSF1R P07333 2/20 0.42
BTK Q06187 2/20 0.41
PLK1 P53350 2/20 0.40
KDM4E B2RXH2 1/20 0.39
BRAF P15056 3/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2B Q13224 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL15670882 0.80 SYK (0.42) SYKCSF1RPLK1KDM4ENPC1
SCHEMBL21178268 0.79 SYK (0.50) SYK
SCHEMBL30823311 0.79 SYK (0.50) SYK
SCHEMBL30823296 0.78 IP6K1 (0.44) KDM4ENPC1RAB9AGRIN1GRIN2B
SCHEMBL21177866 0.78 IP6K1 (0.44) KDM4ENPC1RAB9AGRIN1GRIN2B
SCHEMBL15680515 0.78 SYK (0.41) SYKCSF1RPLK1NPC1RAB9A
SCHEMBL10324086 0.76 SYK (0.48) SYKNPC1RAB9A
SCHEMBL30823267 0.73 PDE2A (0.45) CSF1RKDM4ENPC1RAB9AMAOB
SCHEMBL21178285 0.73 PDE2A (0.45) CSF1RKDM4ENPC1RAB9AMAOB
SCHEMBL20299371 0.70 SYK (0.40) SYKBRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111757876-B DNA-PK inhibitors 沃泰克斯药物股份有限公司 2024-03-22 CN disclosed
US-20200353101-A1 DNA-PK INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2020-11-12 US disclosed
CN-111757876-A DNA-PK inhibitors 沃泰克斯药物股份有限公司 2020-10-09 CN disclosed
WO-2019143678-A1 DNA-PK INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2019-07-25 WO 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-20200353101-A1 DNA-PK INHIBITORS POLK, DTYMK, DCK SYK 2655/4885CSF1R 3994/4885BTK 929/4885

“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.