SCHEMBL24936259

SCHEMBL24936259

COc1ccnc(OCC2(CNC(=O)OC(C)(C)C)CC2)c1-c1cc(N)n[nH]1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.50
CHEK1 O14757 9/20 0.47
ACACB O00763 1/20 0.33
ACACA Q13085 1/20 0.33
IRAK4 Q9NWZ3 3/20 0.33
HSD17B10 Q99714 2/20 0.33
CCNT1 O60563 1/20 0.33
CDK9 P50750 1/20 0.33
DRD2 P14416 2/20 0.33
GFER P55789 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL24935467 0.93 CHEK1 (0.47) KCNH2CHEK1ACACBACACAHSD17B10
SCHEMBL24936204 0.87 CHEK1 (0.45) KCNH2CHEK1HSD17B10GFERL3MBTL1
SCHEMBL24936198 0.84 CHEK1 (0.47) KCNH2CHEK1
SCHEMBL30522667 0.83 KCNH2 (0.66) KCNH2CHEK1DRD2
SCHEMBL24936161 0.83 KCNH2 (0.66) KCNH2CHEK1DRD2
SCHEMBL24936282 0.82 KCNH2 (0.77) KCNH2CHEK1
SCHEMBL31188683 0.79 KCNH2 (0.35) KCNH2CHEK1ACACBACACAL3MBTL1
SCHEMBL24936150 0.78 KCNH2 (0.57) KCNH2CHEK1DRD2
SCHEMBL24936172 0.76 CHEK1 (0.72) KCNH2CHEK1
SCHEMBL24936266 0.76 KCNH2 (0.53) KCNH2DRD2

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-11564920-B2 5-heteroaryl-1H-pyrazol-3-amine derivative Sumitomo Pharma Co., Ltd. (JP) 2023-01-31 US disclosed
US-20230025065-A1 5-HETEROARYL-1H-PYRAZOL-3-AMINE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2023-01-26 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 (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-11564920-B2 5-heteroaryl-1H-pyrazol-3-amine derivative CHEK1, CHEK2, RB1 KCNH2 2700/4885CHEK1 1/4885ACACB 3588/4885
US-20230025065-A1 5-HETEROARYL-1H-PYRAZOL-3-AMINE DERIVATIVE CHEK1, CHEK2, RB1 KCNH2 2700/4885CHEK1 1/4885ACACB 3588/4885

“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.