SCHEMBL18967486

SCHEMBL18967486

N=C(Nc1ccncc1)c1ccc(Cn2ccc3cnccc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 10/20 0.47
KDR P35968 10/20 0.47
PLAU P00749 2/20 0.44
PLG P00747 1/20 0.44
MAOB P27338 2/20 0.42
F2 P00734 1/20 0.41
F10 P00742 1/20 0.41
PRSS1 P07477 1/20 0.41
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40

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
SCHEMBL18967932 0.83 FLT1 (0.52) FLT1KDRPLAUPLGMAOB
SCHEMBL18952014 0.82 FLT1 (0.44) FLT1KDRPLAUPLGMAOB
SCHEMBL18939136 0.81 PLAU (0.67) FLT1KDRPLAUPLGF2
SCHEMBL18968057 0.81 RECQL (0.39) FLT1KDRHDAC2HDAC6
SCHEMBL18952046 0.81 PLAU (0.49) FLT1KDRPLAUPLGHDAC1
Hydrochloric Acid SCHEMBL18939038 0.80 PLAU (0.48) FLT1KDRPLAUPLGHDAC1
SCHEMBL18967494 0.79 PLAU (0.40) KDRPLAUPLGF2F10
SCHEMBL30167818 0.77 FLT1 (0.64) FLT1KDRMAOBHDAC1HDAC2
SCHEMBL18960794 0.76 FLT1 (0.42) FLT1KDRPLAUPLGMAOB
SCHEMBL18939141 0.75 FLT1 (0.54) FLT1KDRMAOB

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-9751894-B2 Cephem compounds, their production and use NAEJA-RGM PHARMACEUTICALS INC. (CA) 2017-09-05 US disclosed
US-20170166587-A1 CEPHEM COMPOUNDS, THEIR PRODUCTION AND USE NAEJA-RGM PHARMACEUTICALS ULC (CA) 2017-06-15 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-20170166587-A1 CEPHEM COMPOUNDS, THEIR PRODUCTION AND USE CEP170, AADAC, NAA50 FLT1 3469/4885KDR 3855/4885PLAU 4395/4885

“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.