SCHEMBL1772148

SCHEMBL1772148

Nc1cnc2[nH]c(CO)cc2c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.45
BRD4 O60885 1/20 0.35
CCNK O75909 1/20 0.33
CDK12 Q9NYV4 1/20 0.33
NUDT1 P36639 1/20 0.32
CLK1 P49759 1/20 0.31
DYRK1A Q13627 1/20 0.31
DYRK2 Q92630 1/20 0.31
DYRK1B Q9Y463 1/20 0.31
HIF1A Q16665 1/20 0.31
PKM P14618 1/20 0.31
SRC P12931 1/20 0.30
KDM5A P29375 1/20 0.30
KDM4C Q9H3R0 1/20 0.30
KDM5B Q9UGL1 1/20 0.30
NTRK1 P04629 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
SCHEMBL1772724 0.82 BRD4 (0.50) ABL1BRD4HIF1A
SCHEMBL3712369 0.80 GABRA5 (0.38) ABL1BRD4HIF1ASRC
SCHEMBL16537462 0.79 ABL1 (0.51) ABL1BRD4CCNKCDK12NUDT1
SCHEMBL13204734 0.79 ABL1 (0.45) ABL1BRD4CCNKCDK12NUDT1
SCHEMBL1772097 0.78 ABL1 (0.47) ABL1BRD4SRCKDM5AKDM5B
SCHEMBL1772466 0.78 BRD4 (0.35) ABL1BRD4
SCHEMBL23974709 0.76 RIPK1 (0.31)
SCHEMBL18370675 0.75 ABL1 (0.42) ABL1BRD4
SCHEMBL15839990 0.72 KIT (0.40)
SCHEMBL3661214 0.72 BRD4 (0.47) BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338452-B2 Raf inhibitor compounds and methods of use thereof ARRAY BIOPHARMA INC. (US) 2012-12-25 US disclosed
US-20110110889-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF Array Bio Pharma Inc. (US) 2011-05-12 US disclosed
EP-2265608-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2010-12-29 EP disclosed
WO-2009111278-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2009-09-11 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-20110110889-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF ABL1 210/4885BRD4 3329/4885CCNK 279/4885

“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.