SCHEMBL2571902

SCHEMBL2571902

CC(=O)CC(=O)Nc1cc(Cl)c2[nH]ncc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ROCK1 Q13464 5/20 0.44
▸ RPS6KB1 P23443 2/20 0.44
▸ RPS6KA1 Q15418 1/20 0.44
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ ROCK2 O75116 4/20 0.42
▸ CLK2 P49760 2/20 0.41
▸ PRKX P51817 2/20 0.41
▸ PKN2 Q16513 2/20 0.41
▸ CLK4 Q9HAZ1 2/20 0.41
▸ STK17A Q9UEE5 2/20 0.41
▸ CAMK2D Q13557 1/20 0.41
▸ MAPT P10636 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ MAOB P27338 2/20 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
SCHEMBL2571077 0.75 ROCK2 (0.74) ROCK1RPS6KB1MEN1KMT2AALDH1A1
SCHEMBL2571909 0.74 ROCK2 (0.46) ROCK1RPS6KB1MEN1KMT2AALDH1A1
SCHEMBL2912762 0.73 ALDH1A1 (0.47) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL10632953 0.71 MEN1 (0.44) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL21348749 0.71 NOS1 (0.42) ROCK1RPS6KB1RPS6KA1MEN1KMT2A
SCHEMBL15215515 0.70 KMT2A (0.58) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL11575557 0.70 ROCK2 (0.57) ROCK1RPS6KB1MEN1KMT2AKDM4E
SCHEMBL9430029 0.69 L3MBTL1 (0.59) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL13495830 0.69 KDM4E (0.46) ROCK1RPS6KB1ALDH1A1KDM4EROCK2
SCHEMBL12647582 0.69 NOS1 (0.40) CYP2C19MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1633740-B1 5-(ACYLAMINO)INDAZOLE DERIVATIVES AS KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2011-11-09 — — EP disclosed
US-7560467-B2 Indazolo-tetrahydropyrimidine-carboxamide derivative kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2009-07-14 — — US disclosed
US-20070099944-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2007-05-03 — — 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-20070099944-A1 Chemical compounds ROCK1, ROCK2, CIT ROCK1 1/4885RPS6KB1 447/4885RPS6KA1 218/4885

“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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