SCHEMBL1256304

SCHEMBL1256304

O=C(Cc1ccc(Br)cc1)Nc1cc(C2(CO)CC2)on1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAPDH P04406 1/20 0.47
MEN1 O00255 7/20 0.45
KMT2A Q03164 7/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
KDM4E B2RXH2 1/20 0.44
NLRP3 Q96P20 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 3/20 0.40
KIT P10721 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
SCHEMBL1256318 0.89 GAPDH (0.46) GAPDHMEN1KMT2ANPC1RAB9A
SCHEMBL1257339 0.87 KLK7 (0.45) GAPDHMEN1KMT2ANPC1RAB9A
SCHEMBL1255093 0.85 GAPDH (0.52) GAPDHMEN1KMT2ANPC1RAB9A
SCHEMBL1255130 0.83 GAPDH (0.50) GAPDHMEN1KMT2ANPC1RAB9A
SCHEMBL1256264 0.81 KIT (0.56) GAPDHMEN1KMT2ANPC1RAB9A
SCHEMBL1257156 0.80 KIT (0.53) GAPDHMEN1KMT2ANPC1RAB9A
SCHEMBL1256800 0.73 FLT3 (0.62) GAPDHNPC1RAB9AKDM4EHTT
SCHEMBL1256289 0.72 GAPDH (0.51) GAPDHMEN1KMT2ANPC1RAB9A
SCHEMBL1256872 0.71 KIT (0.47) GAPDHMEN1KMT2AKIT
SCHEMBL1256836 0.71 KIT (0.47) GAPDHMEN1KMT2AKIT

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-20130035326-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2013-02-07 US disclosed
EP-2467137-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2012-06-27 EP disclosed
WO-2011022473-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2011-02-24 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-20130035326-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF FLT3, CSF3R, CSF1R GAPDH 1316/4885MEN1 1373/4885KMT2A 293/4885

“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.