SCHEMBL6489723

SCHEMBL6489723

O=CN(c1ccncc1)c1c(O)nc2cccc(Cl)c2c1O

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.32
▸ ELANE P08246 1/20 0.30
▸ TYK2 P29597 2/20 0.30
▸ JAK2 O60674 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ JAK1 P23458 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL6501364 0.85 ELANE (0.33) PARP1ELANE
SCHEMBL6488965 0.80 ERN1 (0.38) CYP3A4KDM4EMEN1ALDH1A1TSHR
SCHEMBL6492079 0.76 PDGFRB (0.35) KDM4EMEN1ALDH1A1KMT2A
SCHEMBL6490421 0.74 PDE3B (0.40) CYP3A4KDM4EMEN1ALDH1A1KMT2A
SCHEMBL6499100 0.71 PFKFB3 (0.37) KDM4EALDH1A1HSD17B10
SCHEMBL11417483 0.70 MEN1 (0.46) PARP1ELANEKDM4EMEN1ALDH1A1
SCHEMBL6502506 0.69 ERN1 (0.38) KDM4EMEN1ALDH1A1KMT2A
SCHEMBL6489727 0.67 TYK2 (0.62) TYK2JAK2CYP3A4JAK1MEN1
SCHEMBL9276050 0.62 KMT2A (0.43) CYP3A4KDM4EMEN1ALDH1A1KMT2A
SCHEMBL3456737 0.62 PSMB8 (0.41) PARP1ELANECYP3A4KDM4EMEN1

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-6908932-B2 Cancer therapy ICONIX PHARMACEUTICALS, INC. (US) 2005-06-21 — — US disclosed
US-20030149074-A1 Modulators of phosphoinositide 3-kinase ENTELOS HOLDING CORP. 2003-08-07 — — US disclosed
WO-2003035618-A2 MODULATORS OF PHOSPHOINOSITIDE 3-KINASE ICONIX PHARMACEUTICALS, INC. (US) 2003-05-01 — — WO 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-20030149074-A1 Modulators of phosphoinositide 3-kinase PIK3R1, PIK3R3, PIK3R4 PARP1 2261/4885ELANE 3614/4885TYK2 263/4885

“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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