SCHEMBL13941708

SCHEMBL13941708

CC(=N)N/N=C(\C)c1ccc(NC(=O)c2cc3c(ccc4ccccc43)[nH]2)cc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 4/20 0.52
▸ PIK3CA P42336 4/20 0.52
▸ ALDH1A1 P00352 5/20 0.47
▸ LMNA P02545 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ MAPT P10636 5/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ RAB9A P51151 8/20 0.44
▸ NPC1 O15118 6/20 0.44
▸ CTDSP1 Q9GZU7 1/20 0.44
▸ POLB P06746 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ TP53 P04637 2/20 0.43
▸ HTT P42858 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ BRD4 O60885 1/20 0.42

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
SCHEMBL13941520 0.92 PLK4 (0.52) EGFRPIK3CAALDH1A1LMNAKDM4E
SCHEMBL13941576 0.81 NPC1 (0.61) EGFRPIK3CAALDH1A1LMNAKDM4E
SCHEMBL13941655 0.81 EGFR (0.51) EGFRPIK3CAALDH1A1LMNAKDM4E
SCHEMBL13941573 0.81 EGFR (0.51) EGFRPIK3CAALDH1A1KDM4EMAPT
SCHEMBL13941641 0.80 EGFR (0.50) EGFRPIK3CAALDH1A1LMNAKDM4E
SCHEMBL13941656 0.80 NHERF1 (0.54) EGFRPIK3CAMAPTMEN1KMT2A
SCHEMBL13941626 0.80 EGFR (0.61) EGFRPIK3CALMNAKDM4EMEN1
SCHEMBL30093765 0.80 LMNA (0.68) EGFRPIK3CAALDH1A1LMNAKDM4E
SCHEMBL14739105 0.80 LMNA (0.68) EGFRPIK3CAALDH1A1LMNAKDM4E
SCHEMBL13941369 0.79 EGFR (0.66) EGFRPIK3CAALDH1A1LMNAKDM4E

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-8765802-B2 Kinase inhibitors, compositions thereof, and methods of use therewith PROVID PHARMACEUTICALS, INC. (US) 2014-07-01 — — US disclosed
US-20090018141-A1 KINASE INHIBITORS, COMPOSITIONS THEREOF, AND METHODS OF USE THEREWITH PROVID PHARMACEUTICALS, INC. 2009-01-15 — — 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-20090018141-A1 KINASE INHIBITORS, COMPOSITIONS THEREOF, AND METHODS OF USE THEREWITH CHEK2, ATM, CHEK1 EGFR 1827/4885PIK3CA 821/4885ALDH1A1 4484/4885

“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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