SCHEMBL19656293

SCHEMBL19656293

COC(=O)Cn1cc(-c2ccc(Br)cc2)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.48
CCNC P24863 7/20 0.43
CDK8 P49336 7/20 0.43
HPGD P15428 2/20 0.42
SYK P43405 1/20 0.41
CTSK P43235 1/20 0.41
CTSC P53634 1/20 0.41
FLT3 P36888 1/20 0.40
MYLK Q15746 1/20 0.40
AURKB Q96GD4 1/20 0.40
CILK1 Q9UPZ9 1/20 0.40
CDK11A Q9UQ88 1/20 0.40
FAAH O00519 1/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39

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
SCHEMBL25170515 0.85 KCNH2 (0.45) KCNH2CCNCCDK8FLT3MYLK
SCHEMBL21662459 0.82 KCNH2 (0.49) KCNH2CCNCCDK8FLT3MYLK
SCHEMBL1140333 0.82 ALDH1A1 (0.46) HPGDSYKMEN1KMT2A
SCHEMBL22642936 0.80 KCNH2 (0.53) KCNH2CTSKCTSCNAMPT
SCHEMBL26929522 0.80 CCNC (0.60) KCNH2CCNCCDK8FLT3MYLK
SCHEMBL19155220 0.79 CTSK (0.53) KCNH2SYKCTSKCTSCNAMPT
SCHEMBL13117201 0.78 SYK (0.44) CCNCCDK8SYKCTSKCTSC
SCHEMBL19656294 0.77 FFAR1 (0.43) CCNCCDK8SYKFLT3MYLK
SCHEMBL16100863 0.75 KCNH2 (0.55) KCNH2
SCHEMBL19656317 0.74 CCNC (0.45) CCNCCDK8HPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11840531-B2 CDK8/19 inhibitors JOINT STOCK COMPANY "BIOCAD" (RU) 2023-12-12 US disclosed
US-11840531-B2 CDK8/19 inhibitors JOINT STOCK COMPANY "BIOCAD" (RU) 2023-12-12 US disclosed
US-20210246138-A1 CDK8/19 INHIBITORS JOINT STOCK COMPANY "BIOCAD" (RU) 2021-08-12 US disclosed
EP-3831829-A1 CDK8/19 INHIBITORS Joint Stock Company "Biocad" (RU) 2021-06-09 EP disclosed
EP-3464267-B1 NEW PHENYLPYRAZOLYLACETAMIDE COMPOUNDS AND DERIVATIVES AS CDK8/CDK19 INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2020-09-23 EP disclosed
WO-2020027704-A1 CDK8/19 INHIBITORS ЗАКРЫТОЕ АКЦИОНЕРНОЕ ОБЩЕСТВО "БИОКАД" 2020-02-06 WO disclosed
WO-2017202719-A1 NEW PHENYLPYRAZOLYLACETAMIDE COMPOUNDS AND DERIVATIVES AS CDK8/CDK19 INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-11-30 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 (2 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-11840531-B2 CDK8/19 inhibitors CDK8, CDK9, CDK18 KCNH2 4298/4885CCNC 35/4885CDK8 1/4885
US-20210246138-A1 CDK8/19 INHIBITORS CDK8, CDK9, CDK18 KCNH2 4298/4885CCNC 35/4885CDK8 1/4885

“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.