SCHEMBL6792392

SCHEMBL6792392

CC(C)(C)OC(=O)NCCn1nc2c(c1C(=O)O)CCc1cnccc1-2.[LiH]

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
LATS1 O95835 2/20 0.35
CYP3A4 P08684 1/20 0.35
DRD2 P14416 2/20 0.34
CCNT1 O60563 2/20 0.34
CDK9 P50750 2/20 0.34
NAMPT P43490 1/20 0.34
METAP2 P50579 1/20 0.33
CKS1B P61024 1/20 0.33
SKP1 P63208 1/20 0.33
SKP2 Q13309 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
Lithium Ion SCHEMBL6792381 0.90 CYP11B1 (0.39) CYP11B1CYP11B2LATS1CYP3A4DRD2
SCHEMBL6794857 0.89 CYP11B1 (0.38) CYP11B1CYP11B2LATS1CYP3A4DRD2
SCHEMBL6793980 0.84 LATS1 (0.37) CYP11B1CYP11B2LATS1CYP3A4DRD2
Hydrochloric Acid SCHEMBL6787345 0.82 ROCK2 (0.32) NAMPT
SCHEMBL6793729 0.80 CYP3A4 (0.38) CYP11B1CYP11B2LATS1CYP3A4DRD2
SCHEMBL6787398 0.80 CYP3A4 (0.38) CYP11B1CYP11B2LATS1CYP3A4DRD2
SCHEMBL6793304 0.80 KDM4C (0.37)
Hydrochloric Acid SCHEMBL6795179 0.80 NAMPT (0.33) NAMPT
SCHEMBL6794500 0.80 CYP11B1 (0.38) CYP11B1CYP11B2LATS1CYP3A4DRD2
SCHEMBL6794639 0.79 HCAR2 (0.42) CYP11B1CYP11B2DRD2

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-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 PHARMACIA CORPORATION 2004-07-01 US claimed
US-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 PHARMACIA CORPORATION 2004-07-01 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-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 MKNK2, MAPKAPK2, MAP3K2 CYP11B1 785/4885CYP11B2 524/4885LATS1 1396/4885

“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.