SCHEMBL22486473

SCHEMBL22486473

CC1(C)OB(c2ccc(C3=NC(c4ccccc4)NC(c4cc(-c5ccccc5)cc(-c5ccccc5)c4)=N3)cc2)OC1(C)C

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 9/20 0.51
LPL P06858 8/20 0.51
DGAT1 O75907 1/20 0.33
P4HB P07237 1/20 0.32
SNCA P37840 1/20 0.31
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
PDGFRB P09619 1/20 0.31
KDR P35968 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL21781485 0.93 LIPG (0.52) LIPGLPLDGAT1P4HBSNCA
SCHEMBL20407029 0.93 LIPG (0.52) LIPGLPLDGAT1P4HBSNCA
SCHEMBL20038797 0.87 LIPG (0.39) LIPGLPL
SCHEMBL19774525 0.87 LIPG (0.40) LIPGLPL
SCHEMBL16189113 0.83 LPL (0.34) LIPGLPL
SCHEMBL23075595 0.82 LPL (0.40) LIPGLPLSNCACA1CA2
SCHEMBL29313718 0.79 LPL (0.36) LIPGLPL
SCHEMBL21781499 0.78 LIPG (0.41) LIPGLPLDGAT1
SCHEMBL20038798 0.78 NISCH (0.39)
SCHEMBL18644042 0.77 NOS2 (0.42)

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-20200308150-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME HEESUNG MATERIAL LTD. (KR) 2020-10-01 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-20200308150-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME CRY1, CYP1A1, CYP1B1 LIPG 3750/4885LPL 3165/4885DGAT1 418/4885

“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.