SCHEMBL4511031

SCHEMBL4511031

COc1cccc2c(=O)[nH]c(-c3cc4ccccc4o3)nc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 10/20 0.62
TNKS2 Q9H2K2 10/20 0.62
PARP2 Q9UGN5 6/20 0.62
PARP1 P09874 4/20 0.57
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
HPGD P15428 1/20 0.50
CYP2C19 P33261 1/20 0.50
KMT2A Q03164 1/20 0.50
CSNK2A2 P19784 2/20 0.49
CSNK2B P67870 2/20 0.49
PIM1 P11309 1/20 0.49
PIM3 Q86V86 1/20 0.49
PIM2 Q9P1W9 1/20 0.49
CYP1A1 P04798 1/20 0.45
CYP1B1 Q16678 1/20 0.45
TUBB4A P04350 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
SCHEMBL4509710 0.86 CYP1A1 (0.46) TNKSTNKS2PARP2PARP1KDM4E
SCHEMBL4499752 0.84 TNKS (0.60) TNKSTNKS2PARP2PARP1KDM4E
SCHEMBL29827275 0.84 TUBB4A (0.47) TNKSTNKS2PARP2PARP1KDM4E
SCHEMBL28613470 0.84 TUBB4A (0.47) TNKSTNKS2PARP2PARP1KDM4E
SCHEMBL4508581 0.82 PIM1 (0.50) TNKSTNKS2PARP2PARP1KDM4E
SCHEMBL4508759 0.81 TNKS (0.45) TNKSTNKS2PARP2PARP1KDM4E
SCHEMBL4505157 0.81 PIM1 (0.49) KDM4EALDH1A1HPGDCSNK2A2CSNK2B
SCHEMBL4498837 0.80 KDM4E (0.50) TNKSTNKS2PARP2PARP1KDM4E
SCHEMBL4503194 0.79 GUSB (0.47) TNKSTNKS2PARP2PARP1KDM4E
SCHEMBL4497483 0.79 KDM4E (0.46) TNKSTNKS2PARP2PARP1KDM4E

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-20090318479-A1 SUBSTITUTED RING FUSED AZINES AND THEIR USE IN CANCER THERAPY AUCKLAND UNISERVICES LIMITED 2009-12-24 US claimed
US-20090318479-A1 SUBSTITUTED RING FUSED AZINES AND THEIR USE IN CANCER THERAPY AUCKLAND UNISERVICES LIMITED 2009-12-24 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-20090318479-A1 SUBSTITUTED RING FUSED AZINES AND THEIR USE IN CANCER THERAPY TP53, AZI2, MCL1 TNKS 116/4885TNKS2 78/4885PARP2 51/4885

“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.