SCHEMBL24936239

SCHEMBL24936239

COc1cncc(O[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)c1-c1cc(N)n[nH]1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 3/20 0.41
KCNH2 Q12809 2/20 0.41
PDE4B Q07343 4/20 0.35
TRPC6 Q9Y210 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HTT P42858 1/20 0.33
IDO1 P14902 1/20 0.33
EHMT2 Q96KQ7 1/20 0.33
HSD17B10 Q99714 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
TBK1 Q9UHD2 1/20 0.32
PIK3CA P42336 2/20 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
SCHEMBL24936201 0.84 CHEK1 (0.42) CHEK1KCNH2MEN1KMT2AHTT
SCHEMBL24936158 0.83 CHEK1 (0.41) CHEK1KCNH2PDE4BTRPC6MEN1
SCHEMBL24936199 0.80 CHEK1 (0.71) CHEK1KCNH2
SCHEMBL24936313 0.79 ALOX5AP (0.45) CHEK1KCNH2PDE4BTRPC6MEN1
SCHEMBL24936208 0.78 CHEK1 (0.43) CHEK1KCNH2TRPC6GPR119
SCHEMBL24935425 0.77 CHEK1 (0.44) CHEK1KCNH2GPR119
SCHEMBL24936252 0.77 CHEK1 (0.46) CHEK1KCNH2MEN1KMT2AGPR119
SCHEMBL24936312 0.76 EPHA2 (0.48) CHEK1KCNH2PDE4BMEN1KMT2A
SCHEMBL24936308 0.76 EPHA2 (0.48) CHEK1KCNH2PDE4BMEN1KMT2A
SCHEMBL24936160 0.74 CHEK1 (0.42) CHEK1KCNH2PDE4BGPR119PIK3CA

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 CHEK1 1/4885KCNH2 2700/4885PDE4B 2467/4885
US-20230025065-A1 5-HETEROARYL-1H-PYRAZOL-3-AMINE DERIVATIVE CHEK1, CHEK2, RB1 CHEK1 1/4885KCNH2 2700/4885PDE4B 2467/4885

“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.