SCHEMBL14004875

SCHEMBL14004875

CC(C)(C)OC(=O)N1CCC[C@H](Oc2cncc(C(C)(C)C)c2)C1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 1/20 0.49
CYP11B2 P19099 3/20 0.43
PDE4B Q07343 1/20 0.43
USP30 Q70CQ3 1/20 0.43
PIK3CD O00329 6/20 0.43
P2RX3 P56373 1/20 0.43
P2RX2 Q9UBL9 1/20 0.43
CYP2C9 P11712 1/20 0.41
PRMT5 O14744 2/20 0.40
WDR77 Q9BQA1 1/20 0.40
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP11B1 P15538 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
SCHEMBL16195910 0.87 CHEK2 (0.49) CHEK2CYP11B2PDE4BUSP30PIK3CD
SCHEMBL14780124 0.87 CHEK2 (0.49) CHEK2CYP11B2PDE4BUSP30PIK3CD
SCHEMBL14780123 0.87 CHEK2 (0.49) CHEK2CYP11B2PDE4BUSP30PIK3CD
SCHEMBL14004872 0.86 GPR119 (0.51) CHEK2PDE4BMAPT
SCHEMBL4742807 0.86 CHEK2 (0.51) CHEK2CYP11B2PDE4BUSP30PIK3CD
SCHEMBL4784604 0.86 CHEK2 (0.51) CHEK2CYP11B2PDE4BUSP30PIK3CD
SCHEMBL4745263 0.84 CHEK2 (0.49) CHEK2CYP11B2PDE4BUSP30PIK3CD
SCHEMBL4745261 0.84 CHEK2 (0.49) CHEK2CYP11B2PDE4BUSP30PIK3CD
SCHEMBL6305698 0.81 GPR119 (0.53) CHEK2USP30CYP2C9PRMT5WDR77
SCHEMBL29686325 0.81 PIK3CD (0.49) PDE4BUSP30PIK3CDALDH1A1

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-20080293712-A1 Benzo[C][2,7]Naphtyridine Derivatives, Methods of Making Thereof and Methods of Use Thereof WYETH (US) 2008-11-27 US disclosed
US-20080293712-A1 Benzo[C][2,7]Naphtyridine Derivatives, Methods of Making Thereof and Methods of Use Thereof WYETH (US) 2008-11-27 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-20080293712-A1 Benzo[C][2,7]Naphtyridine Derivatives, Methods of Making Thereof and Methods of Use Thereof PDPK1, PDK2, PDK3 CHEK2 536/4885CYP11B2 1289/4885PDE4B 375/4885

“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.