SCHEMBL6958291

SCHEMBL6958291

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nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.35
TDP1 Q9NUW8 3/20 0.35
EBP Q15125 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
ALDH1A1 P00352 5/20 0.34
POLB P06746 2/20 0.34
HTT P42858 2/20 0.34
BLM P54132 1/20 0.34
TSHR P16473 1/20 0.34
ATM Q13315 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL6980258 0.82 EBP (0.37) KDM4ETDP1EBPSIGMAR1ALDH1A1
SCHEMBL6959426 0.79 PSMB1 (0.33) KDM4EALDH1A1HTTMEN1KMT2A
SCHEMBL6956708 0.78 SMN1; SMN2 (0.35) KDM4ETDP1ALDH1A1POLBMEN1
SCHEMBL6959150 0.78
SCHEMBL6955686 0.76 GNAI3 (0.34)
SCHEMBL9975318 0.75 EBP (0.43) KDM4ETDP1EBPSIGMAR1ALDH1A1
SCHEMBL6960155 0.74
SCHEMBL6959774 0.73 HTR1A (0.36)
SCHEMBL6961257 0.73 PIK3CD (0.41) KDM4ETDP1SIGMAR1ALDH1A1
SCHEMBL6958573 0.72 LTA4H (0.44)

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
US-8349857-B2 Quinazoline derivatives having tyrosine kinase inhibitory activity SHIONOGI & CO., LTD. (JP) 2013-01-08 US disclosed
US-8202879-B2 Quinazoline derivatives having tyrosine kinase inhibitory activity SHIONOGI & CO., LTD. (JP) 2012-06-19 US disclosed
US-20120123114-A1 QUINAZOLINE DERIVATIVES HAVING TYROSINE KINASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-05-17 US disclosed
US-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity SHIONOGI & CO., LTD. (JP) 2009-06-04 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 (2 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-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity ERBB2, EGFR, ABL1 KDM4E 2805/4885TDP1 4067/4885EBP 3224/4885
US-20120123114-A1 QUINAZOLINE DERIVATIVES HAVING TYROSINE KINASE INHIBITORY ACTIVITY ERBB2, EGFR, ABL1 KDM4E 2805/4885TDP1 4067/4885EBP 3224/4885

“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.