SCHEMBL18327540

SCHEMBL18327540

c1ccc(-c2ccnc(-c3cc(-c4cnc5ccccc5c4)cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 3/20 0.56
▸ PDGFRA P16234 3/20 0.56
▸ MAP4K4 O95819 2/20 0.50
▸ CSNK1G2 P78368 2/20 0.50
▸ CLK4 Q9HAZ1 2/20 0.50
▸ MKNK2 Q9HBH9 2/20 0.50
▸ CYP2A6 P11509 1/20 0.50
▸ MAP4K5 Q9Y4K4 1/20 0.50
▸ BIRC5 O15392 1/20 0.49
▸ PIK3CD O00329 2/20 0.48
▸ PIK3CA P42336 2/20 0.48
▸ PIK3CB P42338 1/20 0.48
▸ MTOR P42345 1/20 0.48
▸ PIK3CG P48736 1/20 0.48
▸ MAPKAPK2 P49137 3/20 0.44
▸ PIM1 P11309 2/20 0.44
▸ CLK2 P49760 2/20 0.44
▸ DYRK1A Q13627 2/20 0.44
▸ PLK4 O00444 1/20 0.44
▸ DAPK3 O43293 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
SCHEMBL18327652 0.96 PDGFRB (0.55) PDGFRBPDGFRAMAP4K4CSNK1G2CLK4
SCHEMBL18327313 0.87 PDGFRB (0.62) PDGFRBPDGFRAMAP4K4CSNK1G2CLK4
SCHEMBL18327370 0.87 ASIC3 (0.44) PIM1NPC1
SCHEMBL18327362 0.86 PDGFRB (0.60) PDGFRBPDGFRAMAP4K4CSNK1G2CLK4
SCHEMBL19310448 0.86 PDGFRB (0.60) PDGFRBPDGFRAMAP4K4CSNK1G2CLK4
SCHEMBL25449310 0.86 ASIC3 (0.46) PIM1NPC1
SCHEMBL18327542 0.83 GABRA1 (0.49) PDGFRBPDGFRAPIK3CAMAPK12MKNK1
SCHEMBL18325387 0.83 PDGFRB (0.48) PDGFRBPDGFRAMAP4K4CSNK1G2CLK4
SCHEMBL18327606 0.83 MEN1 (0.50) MAP4K4PIM1
SCHEMBL18327373 0.83 MEN1 (0.50) MAP4K4PIM1

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-9812652-B2 Cyclic azine compound having adamantyl group, production method, and organic electroluminescent device containing it as constituent component TOSOH CORPORATION (JP) 2017-11-07 — — US disclosed
US-20160372678-A1 CYCLIC AZINE COMPOUND HAVING ADAMANTYL GROUP, PRODUCTION METHOD, AND ORGANIC ELECTROLUMINESCENT DEVICE CONTAINING IT AS CONSTITUENT COMPONENT TOSOH CORPORATION (JP) 2016-12-22 — — 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-20160372678-A1 CYCLIC AZINE COMPOUND HAVING ADAMANTYL GROUP, PRODUCTION METHOD, AND ORGANIC ELECTROLUMINESCENT DEVICE CONTAINING IT AS CONSTITUENT COMPONENT CHRM1, AFF1, AZI2 PDGFRB 1953/4885PDGFRA 1365/4885MAP4K4 3534/4885

“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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