SCHEMBL12111069

SCHEMBL12111069

C=C(C)Nc1ncc(C)c(Nc2ccc3c(c2)OCO3)n1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 3/20 0.60
ULK1 O75385 7/20 0.55
STK17A Q9UEE5 2/20 0.53
STK17B O94768 1/20 0.47
JUN P05412 1/20 0.46
MAPK10 P53779 1/20 0.46
CDK1 P06493 1/20 0.46
AURKA O14965 1/20 0.46
NPC1 O15118 1/20 0.46
ALOX15 P16050 1/20 0.46
RAB9A P51151 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SYK P43405 2/20 0.45
CHEK1 O14757 1/20 0.45
FLT3 P36888 1/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL19654262 0.88 BRD4 (0.74) BRD4ULK1STK17ASTK17BJUN
SCHEMBL17915936 0.85 BRD4 (0.65) BRD4ULK1STK17ASTK17BJUN
SCHEMBL19654308 0.83 ULK1 (0.76) BRD4ULK1STK17ASTK17BJUN
SCHEMBL19654310 0.83 ULK1 (0.76) BRD4ULK1STK17ASTK17BJUN
SCHEMBL270175 0.82 BRD4 (0.61) BRD4ULK1STK17ASTK17BJUN
SCHEMBL301350 0.82 BRD4 (0.61) BRD4ULK1STK17ASTK17BJUN
SCHEMBL19654328 0.82 ULK1 (0.68) BRD4ULK1STK17ANPC1ALOX15
SCHEMBL12279025 0.81 BRD4 (0.59) BRD4ULK1STK17ANPC1ALOX15
SCHEMBL656136 0.80 BRD4 (0.74) BRD4ULK1STK17ASTK17BAURKA
SCHEMBL19654299 0.80 BRD4 (0.67) BRD4ULK1STK17ACDK1AURKA

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-20110269721-A1 METHODS OF TREATING THALASSEMIA TARGEGEN, INC. (US) 2011-11-03 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-20110269721-A1 METHODS OF TREATING THALASSEMIA JAK2, STAT5A, STAT5B BRD4 1036/4885ULK1 3364/4885STK17A 139/4885

“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.