SCHEMBL29317818

SCHEMBL29317818

COc1cc2nccc(Oc3cc(-n4cccn4)cc(-n4cccn4)c3)c2cc1C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 10/20 0.61
▸ MET P08581 7/20 0.61
▸ TEK Q02763 7/20 0.61
▸ AURKB Q96GD4 6/20 0.61
▸ AURKA O14965 5/20 0.61
▸ LCK P06239 3/20 0.54
▸ ABL1 P00519 2/20 0.54
▸ LYN P07948 1/20 0.54
▸ AXL P30530 2/20 0.51
▸ RET P07949 6/20 0.50
▸ PDGFRB P09619 2/20 0.49
▸ PDGFRA P16234 2/20 0.49
▸ RIPK2 O43353 1/20 0.49
▸ ERN1 O75460 1/20 0.49
▸ STK10 O94804 1/20 0.49
▸ MAP3K6 O95382 1/20 0.49
▸ ESR1 P03372 1/20 0.49
▸ ADORA3 P0DMS8 1/20 0.49
▸ KIT P10721 1/20 0.49
▸ BCR P11274 1/20 0.49

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
SCHEMBL30050696 1.00 KDR (0.61) KDRMETTEKAURKBAURKA
SCHEMBL30050356 0.96 KDR (0.59) KDRMETTEKAURKBAURKA
SCHEMBL29317871 0.96 KDR (0.59) KDRMETTEKAURKBAURKA
SCHEMBL29317820 0.94 KDR (0.57) KDRMETTEKAURKBAURKA
SCHEMBL29319922 0.94 KDR (0.57) KDRMETTEKAURKBAURKA
SCHEMBL30050941 0.94 KDR (0.57) KDRMETTEKAURKBAURKA
SCHEMBL29186565 0.93 KDR (0.55) KDRMETTEKAURKBAURKA
SCHEMBL30049852 0.93 KDR (0.55) KDRMETTEKAURKBAURKA
SCHEMBL29317875 0.86 AXL (0.53) KDRMETTEKAURKBAURKA
SCHEMBL30051321 0.85 AXL (0.54) KDRMETTEKAURKBAURKA

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-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CHENGDU ANTICANCER BIOSCIENCE LTD (CN) 2024-07-18 — — US disclosed
US-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CHENGDU ANTICANCER BIOSCIENCE LTD (CN) 2024-07-18 — — 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-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CYP27A1, CPT1A, OAT KDR 4885/4885MET 4678/4885TEK 4851/4885

“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.

Send feedback