SCHEMBL20183474

SCHEMBL20183474

CC(C)(C)OC(=O)N1CCCC(COc2ncnc3c2ccn3COCC[Si](C)(C)C)C1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.43
FEN1 P39748 3/20 0.43
BCHE P06276 2/20 0.43
HTR6 P50406 2/20 0.43
SCN9A Q15858 1/20 0.41
CHEK2 O96017 1/20 0.41
ACACB O00763 3/20 0.40
PIK3CD O00329 7/20 0.39
PFKFB3 Q16875 1/20 0.39
PIK3CA P42336 2/20 0.38
PIK3CB P42338 2/20 0.38
PIK3CG P48736 2/20 0.38

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
SCHEMBL18419032 0.88 PIK3CD (0.49) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL17527387 0.88 PIK3CD (0.49) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL31124313 0.85 PIK3CD (0.54) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20183873 0.83 GPR119 (0.51) SCN9APIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL29983203 0.80 JAK1 (0.43) PIK3CD
SCHEMBL27028318 0.80 JAK1 (0.43) PIK3CD
SCHEMBL22613074 0.78 BCHE (0.40) BCHEHTR6PIK3CD
SCHEMBL22613075 0.78 BCHE (0.40) BCHEHTR6PIK3CD
SCHEMBL20183473 0.77 ACACB (0.36) SCN9AACACB
SCHEMBL22620109 0.77 HDAC4 (0.40) BCHEHTR6PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10407430-B2 Janus kinase 1 selective inhibitor and pharmaceutical use thereof YANG JI CHEMICAL CO., LTD. (KR) 2019-09-10 US disclosed
US-20180237440-A1 JANUS KINASE 1 SELECTIVE INHIBITOR AND PHARMACEUTICAL USE THEREOF YANG JI CHEMICAL CO., LTD. (KR) 2018-08-23 US disclosed
EP-3327021-A1 JANUS KINASE 1 SELECTIVE INHIBITOR AND PHARMACEUTICAL USE THEREOF Yangji Chemical Co., Ltd. (KR) 2018-05-30 EP 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-10407430-B2 Janus kinase 1 selective inhibitor and pharmaceutical use thereof JAK1, JAK2, JAK3 ALOX5AP 3712/4885FEN1 3292/4885BCHE 4529/4885
US-20180237440-A1 JANUS KINASE 1 SELECTIVE INHIBITOR AND PHARMACEUTICAL USE THEREOF JAK1, JAK2, JAK3 ALOX5AP 3918/4885FEN1 2552/4885BCHE 3320/4885

“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.