SCHEMBL23153249

SCHEMBL23153249

CC(C)(C)OC(=O)N1CCC(S(=O)(=O)N2CCC(c3n[nH]c4ncccc34)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 2/20 0.47
▸ JAK1 P23458 2/20 0.47
▸ TYK2 P29597 2/20 0.47
▸ JAK3 P52333 1/20 0.47
▸ GPR119 Q8TDV5 5/20 0.46
▸ POLB P06746 1/20 0.42
▸ NAMPT P43490 2/20 0.42
▸ CCNT1 O60563 1/20 0.42
▸ CDK9 P50750 1/20 0.42
▸ DTYMK P23919 1/20 0.42
▸ CCNK O75909 1/20 0.41
▸ CDK12 Q9NYV4 1/20 0.41
▸ DDB1 Q16531 1/20 0.41
▸ CRBN Q96SW2 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40

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
SCHEMBL21714188 0.84 HSD11B1 (0.54) JAK2JAK1TYK2JAK3GPR119
SCHEMBL21714627 0.80 CCNT1 (0.55) JAK1GPR119POLBNAMPTCCNT1
SCHEMBL21714335 0.79 JAK1 (0.61) JAK2JAK1TYK2JAK3
SCHEMBL21714519 0.79 HSD11B1 (0.55) JAK2JAK1TYK2JAK3CCNK
SCHEMBL21714165 0.77 JAK1 (0.59) JAK2JAK1TYK2JAK3GPR119
SCHEMBL18324978 0.77 GRM4 (0.52) JAK2JAK3POLBCDK9ALDH1A1
SCHEMBL21714104 0.77 GPR119 (0.48) JAK2JAK1TYK2JAK3GPR119
SCHEMBL20111931 0.76 HSD11B1 (0.54) JAK2JAK1TYK2JAK3
SCHEMBL29468210 0.76 JAK2 (0.52) JAK2JAK1TYK2JAK3GPR119
SCHEMBL14737550 0.76 JAK2 (0.52) JAK2JAK1TYK2JAK3GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10961238-B2 Modulators of hedgehog (Hh) signaling pathway E-THERAPEUTICS PLC (GB) 2021-03-30 — — 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-10961238-B2 Modulators of hedgehog (Hh) signaling pathway SHH, GLI1, SMO JAK2 143/4885JAK1 119/4885TYK2 3517/4885

“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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