SCHEMBL22931673

SCHEMBL22931673

CN1CCC(Cc2ccc(Nc3ncc4c(n3)N(c3cccc(S(=O)(=O)NC(C)(C)C)c3)CC4)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 18/20 0.51
▸ JAK2 O60674 6/20 0.50
▸ FLT3 P36888 3/20 0.50
▸ RET P07949 2/20 0.50
▸ JAK1 P23458 2/20 0.50
▸ WEE1 P30291 2/20 0.50
▸ JAK3 P52333 2/20 0.50
▸ BRDT Q58F21 2/20 0.50
▸ ALK Q9UM73 2/20 0.50
▸ BUB1B O60566 1/20 0.50
▸ BRD2 P25440 1/20 0.50
▸ BRD3 Q15059 1/20 0.50
▸ BMPR1B O00238 1/20 0.44
▸ PLK4 O00444 1/20 0.44
▸ STK25 O00506 1/20 0.44
▸ CIT O14578 1/20 0.44
▸ RIOK3 O14730 1/20 0.44
▸ CHEK1 O14757 1/20 0.44
▸ IKBKB O14920 1/20 0.44
▸ CASK O14936 1/20 0.44

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
SCHEMBL22931674 0.92 BRD4 (0.51) BRD4JAK2FLT3RETJAK1
SCHEMBL22932113 0.89 BRD4 (0.51) BRD4JAK2FLT3RETJAK1
SCHEMBL22931672 0.88 BRD4 (0.54) BRD4JAK2FLT3RETJAK1
SCHEMBL22931677 0.86 BRD4 (0.66) BRD4JAK2FLT3RETJAK1
SCHEMBL22931680 0.86 BRD4 (0.51) BRD4JAK2FLT3RETJAK1
SCHEMBL22932177 0.86 BRD4 (0.52) BRD4JAK2FLT3RETJAK1
SCHEMBL22932007 0.85 BRD4 (0.49) BRD4JAK2FLT3RETJAK1
SCHEMBL22931700 0.85 BRD4 (0.49) BRD4JAK2FLT3RETJAK1
SCHEMBL24406576 0.84 BRD4 (0.51) BRD4JAK2FLT3RETJAK1
SCHEMBL22931675 0.84 BRD4 (0.55) BRD4JAK2FLT3RETJAK1

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-20220144844-A1 SELECTIVE DIHYDROPYRROLOPYRIMIDINE JAK2 INHIBITORS Shanghai Xunhe Pharmaceutical Technology Co. Ltd. (CN) 2022-05-12 — — US disclosed
WO-2021017384-A1 DIHYDRO-PYRROLO-PYRIMIDINE SELECTIVE JAK2 INHIBITOR 上海勋和医药科技有限公司 2021-02-04 — — WO 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-20220144844-A1 SELECTIVE DIHYDROPYRROLOPYRIMIDINE JAK2 INHIBITORS JAK2, JAK1, JAK3 BRD4 115/4885JAK2 1/4885FLT3 11/4885

“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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