SCHEMBL14599691

SCHEMBL14599691

CCOC(=O)COc1ccc(-c2c3nc(c(I)c4ccc([nH]4)c(I)c4nc(c(I)c5ccc2s5)C=C4)C=C3)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 1/20 0.41
▸ PDE3A Q14432 1/20 0.41
▸ P2RY12 Q9H244 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ADORA2A P29274 2/20 0.39
▸ ADORA2B P29275 2/20 0.39
▸ GAA P10253 2/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ F9 P00740 1/20 0.37
▸ F10 P00742 1/20 0.37
▸ ABCG2 Q9UNQ0 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ PTPN1 P18031 1/20 0.36
▸ TOP1 P11387 1/20 0.35
▸ PRMT5 O14744 1/20 0.35

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
SCHEMBL8907605 0.83 ABCG2 (0.52) PDE3BPDE3AP2RY12KDM4EHSD17B10
SCHEMBL14629716 0.82 F9 (0.43) PDE3BPDE3AP2RY12KDM4EHSD17B10
SCHEMBL14599692 0.77 FFAR1 (0.38) PDE3BPDE3AP2RY12KDM4EHSD17B10
SCHEMBL14629730 0.76 MAPT (0.40) KDM4EHSD17B10ALDH1A1TP53MAPT
SCHEMBL14599678 0.76 ATP4A (0.38) KDM4EALDH1A1MAPTHPGD
SCHEMBL14599687 0.74 TOP1 (0.39) ABCG2TOP1CYCS
SCHEMBL14599689 0.74 ADORA2B (0.39) PDE3BPDE3AP2RY12KDM4EHSD17B10
SCHEMBL14599694 0.73 F9 (0.37) PDE3BPDE3AP2RY12KDM4EHSD17B10
SCHEMBL14599693 0.73 F9 (0.36) PDE3BPDE3AP2RY12KDM4EHSD17B10
SCHEMBL14599680 0.72 STAT3 (0.44) TOP1CYCS

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-20070015742-A1 Porphyrin derivatives YAHIOGLU GOKHAN 2007-01-18 — — US disclosed
US-20070015742-A1 Porphyrin derivatives YAHIOGLU GOKHAN 2007-01-18 — — 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-20070015742-A1 Porphyrin derivatives SCO2, CBR3, CBR1 PDE3B 4433/4885PDE3A 4169/4885P2RY12 2588/4885

“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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