SCHEMBL16330055

SCHEMBL16330055

Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.72
HPGD P15428 1/20 0.72
MAPT P10636 4/20 0.66
NPC1 O15118 4/20 0.64
RAB9A P51151 4/20 0.64
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
CYP1A2 P05177 2/20 0.62
CYP2C9 P11712 2/20 0.62
CYP2C19 P33261 2/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2D6 P10635 1/20 0.62
TP53 P04637 2/20 0.61
MDM4 O15151 1/20 0.61
HDAC3 O15379 1/20 0.61
MAPK1 P28482 1/20 0.61
HDAC1 Q13547 1/20 0.61
HDAC2 Q92769 1/20 0.61
KCNMA1 Q12791 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.56

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
SCHEMBL11769542 0.91 POLB (0.77) POLBHPGDMAPTNPC1RAB9A
SCHEMBL30288146 0.91 POLB (0.77) POLBHPGDMAPTNPC1RAB9A
SCHEMBL28195774 0.89 POLB (0.64) POLBHPGDMAPTNPC1RAB9A
SCHEMBL5723835 0.89 POLB (0.64) POLBHPGDMAPTNPC1RAB9A
SCHEMBL30586983 0.88 POLB (0.62) POLBHPGDMAPTNPC1RAB9A
SCHEMBL26114052 0.88 POLB (0.62) POLBHPGDMAPTNPC1RAB9A
SCHEMBL27527542 0.88 HDAC2 (0.72) POLBHPGDMAPTNPC1RAB9A
SCHEMBL14128773 0.88 NPC1 (0.83) POLBHPGDMAPTNPC1RAB9A
SCHEMBL28316791 0.87 POLB (0.57) POLBHPGDMAPTNPC1RAB9A
Iodide SCHEMBL30758631 0.86 MAPT (0.84) POLBHPGDMAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110207956-A1 INTRAMOLECULAR C-H AMINATION WITH PHOSPHORYL AZIDES NATIONAL SCIENCE FOUNDATION 2011-08-25 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-20110207956-A1 INTRAMOLECULAR C-H AMINATION WITH PHOSPHORYL AZIDES CYCS, CCNH, CBR3 POLB 783/4885HPGD 1140/4885MAPT 3785/4885

“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.