SCHEMBL4204275

SCHEMBL4204275

N#Cc1cnc2cc(-c3cccnc3)sc2c1-c1cccc(NC(=O)Nc2cccc(Cl)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.50
XBP1 P17861 1/20 0.50
STAT3 P40763 1/20 0.50
GSK3A P49840 1/20 0.50
GSK3B P49841 1/20 0.50
CDK5 Q00535 1/20 0.50
CDK5R1 Q15078 1/20 0.50
CNR1 P21554 4/20 0.49
ABL1 P00519 1/20 0.46
BCR P11274 1/20 0.46
MEN1 O00255 6/20 0.45
KMT2A Q03164 6/20 0.45
ALDH1A1 P00352 4/20 0.45
POLB P06746 3/20 0.45
KDM4E B2RXH2 2/20 0.45
GAA P10253 2/20 0.45
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 0.45
LMNA P02545 4/20 0.44

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
SCHEMBL4195857 0.95 BRAF (0.66) BRAFSMN1; SMN2XBP1STAT3GSK3A
SCHEMBL4198711 0.94 BRAF (0.59) BRAFSMN1; SMN2XBP1STAT3GSK3A
SCHEMBL4195968 0.91 BRAF (0.70) BRAFSMN1; SMN2ABL1BCRMEN1
SCHEMBL4203385 0.89 BRAF (0.65) BRAFCNR1CNR2
SCHEMBL4201770 0.88 BRAF (0.58) BRAFCNR1ABL1BCRMEN1
SCHEMBL4194851 0.87 BRAF (0.75) BRAFMEN1KMT2AMAPTKDR
SCHEMBL4190525 0.87 BRAF (0.61) BRAFCNR1KDR
SCHEMBL4205770 0.86 BRAF (0.62) BRAFCNR1KDR
SCHEMBL4196576 0.85 BRAF (0.78) BRAFSMN1; SMN2MEN1KMT2A
SCHEMBL4198750 0.85 BRAF (0.67) BRAFABL1BCRMEN1KMT2A

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-20090118276-A1 THIENOPYRIMIDINES, THIENOPYRIDINES, AND PYRROLOPYRIMIDINES AS B-RAF INHIBITORS WYETH (US) 2009-05-07 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-20090118276-A1 THIENOPYRIMIDINES, THIENOPYRIDINES, AND PYRROLOPYRIMIDINES AS B-RAF INHIBITORS BRAF, ARAF, RAF1 BRAF 1/4885SMN1; SMN2 4282/4885XBP1 2907/4885

“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.