SCHEMBL22686552

SCHEMBL22686552

CCC(Cn1ccc2cnc(Cl)nc21)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 6/20 0.39
JAK3 P52333 6/20 0.39
TYK2 P29597 5/20 0.39
JAK1 P23458 5/20 0.39
HTR2A P28223 2/20 0.34
HTR2C P28335 2/20 0.34
RPS6KA3 P51812 1/20 0.32
HTR2B P41595 1/20 0.30
NR3C1 P04150 1/20 0.30
NR3C2 P08235 1/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL22648913 1.00 JAK2 (0.39) JAK2JAK3TYK2JAK1HTR2A
SCHEMBL23168749 1.00 JAK2 (0.39) JAK2JAK3TYK2JAK1HTR2A
SCHEMBL29467008 1.00 JAK2 (0.39) JAK2JAK3TYK2JAK1HTR2A
SCHEMBL22638029 0.84 JAK2 (0.48) JAK2JAK3TYK2JAK1HTR2A
SCHEMBL22648842 0.80 JAK2 (0.45) JAK2JAK3TYK2JAK1RPS6KA3
SCHEMBL29467010 0.80 JAK2 (0.45) JAK2JAK3TYK2JAK1RPS6KA3
SCHEMBL22638003 0.80 JAK2 (0.45) JAK2JAK3TYK2JAK1RPS6KA3
SCHEMBL30881456 0.79 JAK2 (0.33) JAK2JAK3TYK2JAK1RPS6KA3
SCHEMBL17066933 0.79 JAK2 (0.33) JAK2JAK3TYK2JAK1RPS6KA3
SCHEMBL22638005 0.76 JAK2 (0.41) JAK2JAK3TYK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230024521-A1 JAK INHIBITORS VIMALAN BIOSCIENCES, INC. 2023-01-26 US disclosed
CN-115003300-A JAK inhibitors 维玛兰生物科学公司 2022-09-02 CN disclosed
US-11136329-B2 JAK inhibitors VIMALAN BIOSCIENCES, INC. (US) 2021-10-05 US disclosed
US-20210040100-A1 JAK INHIBITORS VIMALAN BIOSCIENCES, INC. 2021-02-11 US disclosed
US-20200369669-A1 JAK INHIBITORS VIMALAN BIOSCIENCES, INC. 2020-11-26 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 (4 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-20200369669-A1 JAK INHIBITORS JAK2, JAK1, JAK3 JAK2 1/4885JAK3 3/4885TYK2 8/4885
US-11136329-B2 JAK inhibitors JAK1, JAK2, JAK3 JAK2 2/4885JAK3 3/4885TYK2 6/4885
US-20230024521-A1 JAK INHIBITORS JAK2, JAK1, JAK3 JAK2 1/4885JAK3 3/4885TYK2 8/4885
US-20210040100-A1 JAK INHIBITORS JAK2, JAK1, JAK3 JAK2 1/4885JAK3 3/4885TYK2 8/4885

“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.