SCHEMBL6000263

SCHEMBL6000263

COCCOc1cc2cncnc2cc1OC

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.46
ENPP1 P22413 1/20 0.46
PDPK1 O15530 4/20 0.45
GAK O14976 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
FGFR4 P22455 1/20 0.44
KDR P35968 5/20 0.44
KDM1A O60341 2/20 0.43
FGFR1 P11362 1/20 0.43
FLT1 P17948 1/20 0.43
FBP1 P09467 1/20 0.43

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
SCHEMBL1253803 0.95 EGFR (0.46) EGFRGAKFGFR4KDM1A
SCHEMBL30001048 0.93 EGFR (0.45) EGFRENPP1PDPK1GAKKDM4E
SCHEMBL30000368 0.93 EGFR (0.45) EGFRENPP1PDPK1GAKKDM4E
SCHEMBL30001229 0.93 EGFR (0.45) EGFRENPP1PDPK1GAKKDM4E
SCHEMBL30000483 0.88 ENPP1 (0.59) EGFRENPP1KDM4EALDH1A1SMN1; SMN2
SCHEMBL241727 0.87 EGFR (0.58) EGFRKDM4EALDH1A1SMN1; SMN2FGFR4
SCHEMBL5682691 0.87 ENPP1 (0.48) EGFRENPP1KDM4EALDH1A1SMN1; SMN2
SCHEMBL30864339 0.87 ENPP1 (0.48) EGFRENPP1KDM4EALDH1A1SMN1; SMN2
SCHEMBL5678927 0.87 ENPP1 (0.48) EGFRENPP1KDM4EALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL8814048 0.85 EGFR (0.56) EGFRKDM4EALDH1A1SMN1; SMN2FGFR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8309133-B2 Nanoparticulate quinazoline derivative formulations ALKERMES PHARMA IRELAND LIMITED (IE) 2012-11-13 US disclosed
EP-1871345-B1 NANOPARTICULATE ERLOTINIB FORMULATIONS ELAN PHARMA INT LTD (IE) 2012-08-01 EP disclosed
US-20060246142-A1 Nanoparticulate quinazoline derivative formulations ELAN PHARMA INTERNATIONAL, LIMITED 2006-11-02 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-20060246142-A1 Nanoparticulate quinazoline derivative formulations KRAS, NRAS, ABL1 EGFR 80/4885ENPP1 3518/4885PDPK1 410/4885

“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.