SCHEMBL21747572

SCHEMBL21747572

NC(=O)Oc1nc(-c2cc(F)ncc2Cl)cs1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CCNK O75909 3/20 0.43
▸ CDK9 P50750 3/20 0.43
▸ PKM P14618 1/20 0.34
▸ AAK1 Q2M2I8 1/20 0.32
▸ GPBAR1 Q8TDU6 1/20 0.32
▸ EIF4E P06730 1/20 0.30
▸ ATP4A P20648 1/20 0.30
▸ ATP4B P51164 1/20 0.30
▸ RORC P51449 1/20 0.30
▸ MAPK14 Q16539 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ RECQL P46063 1/20 0.30
▸ BLM P54132 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
SCHEMBL21747522 0.84 CCNK (0.43) CCNKCDK9PKMAAK1GPBAR1
SCHEMBL21747560 0.78 CCNK (0.54) CCNKCDK9
SCHEMBL21747546 0.78 CCNK (0.41) CCNKCDK9EIF4EGAAMAPT
SCHEMBL21747543 0.76 CCNK (0.52) CCNKCDK9
SCHEMBL28979463 0.75 SMN1; SMN2 (0.52) PKMEIF4ERORCKDM4EPOLB
SCHEMBL28979459 0.75 ATP4A (0.55) ATP4AATP4BKDM4E
SCHEMBL21747535 0.75 CDK9 (0.65) CCNKCDK9EIF4E
SCHEMBL21747558 0.74 CDK9 (0.43) CCNKCDK9PKMAAK1
SCHEMBL21747517 0.73 CCNK (0.54) CCNKCDK9PKMRORCKDM4E
SCHEMBL28411894 0.73 AAK1 (0.34) AAK1GPBAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3613737-B1 NOVEL INHIBITOR OF CYCLIN-DEPENDENT KINASE CDK9 GENFLEET THERAPEUTICS SHANGHAI INC (CN) 2021-12-29 — — EP disclosed
US-10952999-B2 Inhibitor of cyclin-dependent kinase CDK9 GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2021-03-23 — — US disclosed
CN-108727363-B Novel cyclin dependent kinase CDK9 inhibitor 劲方医药科技(上海)有限公司 2020-06-19 — — CN disclosed
US-20200078343-A1 NOVEL INHIBITOR OF CYCLIN-DEPENDENT KINASE CDK9 Shanghai Jiongshuo Pharmaceutical Technology Co., Ltd. (CN) 2020-03-12 — — US disclosed
EP-3613737-A1 NOVEL INHIBITOR OF CYCLIN-DEPENDENT KINASE CDK9 Genfleet Therapeutics (Shanghai) Inc. (CN) 2020-02-26 — — EP 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-10952999-B2 Inhibitor of cyclin-dependent kinase CDK9 CDK9, CDK19, CDK1 CCNK 14/4885CDK9 1/4885PKM 588/4885
US-20200078343-A1 NOVEL INHIBITOR OF CYCLIN-DEPENDENT KINASE CDK9 CDK9, CDK19, CDKL1 CCNK 17/4885CDK9 1/4885PKM 991/4885

“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.

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