SCHEMBL29609262

SCHEMBL29609262

COc1cc(OC)c2c(=O)[nH]cnc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.50
PDE3A Q14432 2/20 0.50
BRD4 O60885 6/20 0.46
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
PDPK1 O15530 1/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SRC P12931 1/20 0.44
MMP12 P39900 1/20 0.42
KMT2A Q03164 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
SIRT5 Q9NXA8 1/20 0.42
PARP1 P09874 1/20 0.41
PKM P14618 1/20 0.41
HDAC3 O15379 2/20 0.40
HDAC4 P56524 2/20 0.40
HDAC1 Q13547 2/20 0.40

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
SCHEMBL615784 1.00 PDE3B (0.50) PDE3BPDE3ABRD4KDM4ENPC1
SCHEMBL3189730 0.88 NPC1 (0.42) PDE3BPDE3ABRD4KDM4ENPC1
SCHEMBL6910259 0.88 NPC1 (0.41) PDE3BPDE3ABRD4KDM4ENPC1
SCHEMBL30353921 0.88 NPC1 (0.42) PDE3BPDE3ABRD4KDM4ENPC1
SCHEMBL30353910 0.86 BRD4 (0.41) PDE3BPDE3ABRD4KDM4ENPC1
SCHEMBL15328198 0.86 BRD4 (0.41) PDE3BPDE3ABRD4KDM4ENPC1
SCHEMBL3181498 0.84 BRD4 (0.41) PDE3BPDE3ABRD4KDM4ENPC1
SCHEMBL3429126 0.84 BRD4 (0.41) PDE3BPDE3ABRD4KDM4ENPC1
SCHEMBL19815522 0.84 HPGD (0.45) KDM4ENPC1PDPK1ALDH1A1HPGD
SCHEMBL2798284 0.83 PARP1 (0.51) KDM4ENPC1PDPK1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107252429-B Novel anti-inflammatory agent 雷斯韦洛吉克斯公司 2023-06-16 CN disclosed
CN-110573505-B C 5 -anilinoquinazoline compounds and their use in the treatment of cancer 阿斯利康(瑞典)有限公司 2023-04-11 CN disclosed
US-11407719-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2022-08-09 US disclosed
CN-114423457-A Method for treating splenomegaly 泰利奥斯制药公司 2022-04-29 CN 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-11407719-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 PDE3B 1272/4885PDE3A 1433/4885BRD4 744/4885

“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.