SCHEMBL18112912

SCHEMBL18112912

Nc1ncc(-c2cccc(S(=O)(=O)NC3CC3)c2)cc1-c1ccc2c(c1)CCNC2=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.52
▸ MAPKAPK2 P49137 6/20 0.49
▸ KCNH2 Q12809 1/20 0.49
▸ PARP10 Q53GL7 6/20 0.47
▸ PARP11 Q9NR21 6/20 0.47
▸ PIK3CD O00329 3/20 0.46
▸ PIK3CB P42338 3/20 0.46
▸ PIK3CG P48736 3/20 0.46
▸ MTOR P42345 1/20 0.46
▸ MAPK9 P45984 1/20 0.43
▸ GSK3B P49841 1/20 0.43
▸ TARS1 P26639 1/20 0.43
▸ BRD4 O60885 1/20 0.43
▸ PIK3C3 Q8NEB9 1/20 0.42

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
SCHEMBL12078765 0.91 KCNH2 (0.59) MAPK1MAPKAPK2KCNH2PARP10PARP11
SCHEMBL12495639 0.88 KCNH2 (0.55) MAPK1MAPKAPK2KCNH2PARP10PARP11
SCHEMBL18123071 0.87 MAPK1 (0.51) MAPK1KCNH2PIK3CDPIK3CBPIK3CG
SCHEMBL12495977 0.87 MAPK1 (0.53) MAPK1MAPKAPK2KCNH2PARP10PARP11
SCHEMBL18113051 0.86 MAPK1 (0.53) MAPK1MAPKAPK2PARP10PARP11MAPK9
SCHEMBL12495999 0.86 KCNH2 (0.57) MAPK1KCNH2PIK3CDPIK3CBPIK3CG
SCHEMBL18112932 0.85 KCNH2 (0.55) MAPK1KCNH2PIK3CDPIK3CBPIK3CG
SCHEMBL12495618 0.85 MAPK1 (0.51) MAPK1KCNH2PARP10PARP11
SCHEMBL12495172 0.85 MAPK1 (0.51) MAPK1MAPKAPK2KCNH2PARP10PARP11
SCHEMBL12496057 0.82 MAPK1 (0.51) MAPK1MAPKAPK2KCNH2PARP10PARP11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016161145-A1 STK4 INHIBITORS FOR TREATMENT OF HEMATOLOGIC MALIGNANCIES DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-10-06 — — WO claimed
US-10710978-B2 STK4 inhibitors for treatment of hematologic malignancies DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-07-14 — — US disclosed
US-20180111916-A1 STK4 INHIBITORS FOR TREATMENT OF HEMATOLOGIC MALIGNANCIES FONDAZIONE CENTRO SAN RAFFAELE (IT) 2018-04-26 — — US disclosed
US-20180111916-A1 STK4 INHIBITORS FOR TREATMENT OF HEMATOLOGIC MALIGNANCIES FONDAZIONE CENTRO SAN RAFFAELE (IT) 2018-04-26 — — US disclosed
WO-2016161145-A1 STK4 INHIBITORS FOR TREATMENT OF HEMATOLOGIC MALIGNANCIES DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-10-06 — — WO disclosed
WO-2016161145-A1 STK4 INHIBITORS FOR TREATMENT OF HEMATOLOGIC MALIGNANCIES DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-10-06 — — 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-20180111916-A1 STK4 INHIBITORS FOR TREATMENT OF HEMATOLOGIC MALIGNANCIES STK4, STK3, STK11 MAPK1 341/4885MAPKAPK2 90/4885KCNH2 2512/4885
US-10710978-B2 STK4 inhibitors for treatment of hematologic malignancies STK4, STK3, STK11 MAPK1 341/4885MAPKAPK2 90/4885KCNH2 2512/4885

“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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