SCHEMBL18812103

SCHEMBL18812103

CCn1cc(-c2cn(-c3ccc(OCF)cc3)c(=O)c3c2ncn3CC)cn1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKACA P17612 1/20 0.35
▸ PRKACG P22612 1/20 0.35
▸ PRKACB P22694 1/20 0.35
▸ ABL1 P00519 5/20 0.33
▸ CSF1R P07333 5/20 0.33
▸ LYN P07948 5/20 0.33
▸ TGFBR1 P36897 5/20 0.33
▸ TGFBR2 P37173 5/20 0.33
▸ SIK1 P57059 5/20 0.33
▸ SIK2 Q9H0K1 5/20 0.33
▸ SIK3 Q9Y2K2 5/20 0.33
▸ PRKAB2 O43741 4/20 0.33
▸ PRKAG1 P54619 4/20 0.33
▸ PRKAA1 Q13131 4/20 0.33
▸ PDE4A P27815 1/20 0.33
▸ PDE4B Q07343 1/20 0.33
▸ PDE4C Q08493 1/20 0.33
▸ PDE4D Q08499 1/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ PDE3B Q13370 1/20 0.33

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
SCHEMBL18077761 0.90 AXL (0.36) PDE4APDE4BPDE4CPDE4DPDK2
SCHEMBL16475039 0.90 ABL1 (0.37) ABL1PDE3BPDE3APDK2
SCHEMBL18812001 0.85 PRKACA (0.35) PRKACAPRKACGPRKACBABL1CSF1R
SCHEMBL17803975 0.85 GRK2 (0.38) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL22421237 0.83 ADORA2B (0.39) ABL1RAB9A
SCHEMBL18077729 0.83 BRD4 (0.36) RAB9AF10
SCHEMBL18812005 0.83 ABL1 (0.46) ABL1FGFR1PDK2MAPK1
SCHEMBL17803745 0.82 ADORA2B (0.37) ABL1PDE3BPDE3APDK2
SCHEMBL16474986 0.80 ABL1 (0.41) ABL1PDE3BPDE3A
SCHEMBL18077656 0.79 PDK2 (0.35) ABL1LYNFGFR1PDK2BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170121345-A1 ANTI-FIBROTIC PYRIDINONES GENENTECH, INC. 2017-05-04 — — 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-20170121345-A1 ANTI-FIBROTIC PYRIDINONES MMP1, COL1A1, COL2A1 PRKACA 3867/4885PRKACG 4019/4885PRKACB 3770/4885

“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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