SCHEMBL13340903

SCHEMBL13340903

CCOc1nc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2CSc2ccccc2)c(-c2ccccc2)n1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 2/20 0.38
SKP1 P63208 2/20 0.38
SKP2 Q13309 2/20 0.38
ABHD6 Q9BV23 1/20 0.36
DAGLA Q9Y4D2 1/20 0.36
USP30 Q70CQ3 4/20 0.36
PARP1 P09874 2/20 0.35
GPR119 Q8TDV5 1/20 0.34
HPGDS O60760 2/20 0.34
PRMT5 O14744 1/20 0.34
ROCK2 O75116 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
JAK2 O60674 1/20 0.33
JAK3 P52333 1/20 0.33
EGFR P00533 1/20 0.33
SRC P12931 1/20 0.33
GBA1 P04062 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL3495634 0.91 ALDH1A1 (0.34) ALDH1A1MEN1KMT2AHPGD
SCHEMBL13341024 0.86 NR1H2 (0.38) CKS1BSKP1SKP2ABHD6DAGLA
SCHEMBL13341021 0.85 CKS1B (0.37) CKS1BSKP1SKP2ABHD6DAGLA
SCHEMBL8229917 0.80 NR1H2 (0.57) ABHD6DAGLAGPR119
SCHEMBL13340982 0.80 NR1H2 (0.44) CKS1BSKP1SKP2ABHD6DAGLA
SCHEMBL3494568 0.76 KMT2A (0.35) KMT2A
SCHEMBL8237600 0.76 ABHD6 (0.48) ABHD6DAGLAPARP1
SCHEMBL3493284 0.75 TP53 (0.34) ALDH1A1HPGD
SCHEMBL13705291 0.72 USP30 (0.34) CKS1BSKP1SKP2ABHD6DAGLA
SCHEMBL13705316 0.72 ABHD6 (0.34) CKS1BSKP1SKP2ABHD6DAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-13 US disclosed
US-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-13 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-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension REN, AGTR1, AGTR2 CKS1B 688/4885SKP1 980/4885SKP2 1706/4885

“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.