SCHEMBL20116304

SCHEMBL20116304

CC(C)(C)OC(=O)N1CCC(c2noc(-c3ccc4cnn(C5CCOC5)c4c3)n2)CC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.47
TBK1 Q9UHD2 1/20 0.46
USP30 Q70CQ3 2/20 0.46
PIK3CA P42336 3/20 0.41
MTOR P42345 3/20 0.41
PIK3CG P48736 3/20 0.41
ATR Q13535 2/20 0.41
AURKB Q96GD4 1/20 0.41
HDAC4 P56524 1/20 0.40
PIK3CD O00329 1/20 0.39
MAPT P10636 1/20 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
SCHEMBL20676725 1.00 GPR119 (0.47) GPR119TBK1USP30PIK3CAMTOR
SCHEMBL22358156 1.00 GPR119 (0.47) GPR119TBK1USP30PIK3CAMTOR
SCHEMBL20116041 0.94 GPR119 (0.49) GPR119TBK1USP30PIK3CAMTOR
SCHEMBL22358038 0.92 PIK3CD (0.41) TBK1USP30PIK3CAMTORPIK3CG
SCHEMBL20116302 0.92 PIK3CD (0.41) TBK1USP30PIK3CAMTORPIK3CG
SCHEMBL20116244 0.92 PIK3CD (0.41) TBK1USP30PIK3CAMTORPIK3CG
SCHEMBL20117085 0.91 USP30 (0.47) GPR119TBK1USP30PIK3CAMTOR
SCHEMBL22358154 0.89 PIK3CD (0.38) GPR119TBK1USP30PIK3CD
SCHEMBL20116314 0.89 TBK1 (0.48) GPR119TBK1USP30PIK3CAMTOR
SCHEMBL22358047 0.89 GPR119 (0.48) GPR119TBK1USP30PIK3CAMTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-20200262828-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2020-08-20 US disclosed
WO-2019209948-A9 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-01-02 WO disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 WO disclosed
WO-2018081167-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2018-05-03 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 (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-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 GPR119 2922/4885TBK1 3534/4885USP30 3526/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 GPR119 2922/4885TBK1 3534/4885USP30 3526/4885

“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.