SCHEMBL17829677

SCHEMBL17829677

O=Cc1n[nH]c2c(Cl)cccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.58
FLT3 P36888 1/20 0.58
PLK3 Q9H4B4 1/20 0.58
DAO P14920 2/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ADRA2A P08913 1/20 0.40
NOS1 P29475 2/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2A6 P11509 1/20 0.37
AR P10275 2/20 0.36
DYRK1A Q13627 3/20 0.36
AHR P35869 1/20 0.35
RARG P13631 1/20 0.35
AURKA O14965 1/20 0.34
DAPK3 O43293 1/20 0.34
JAK2 O60674 1/20 0.34
PRKD3 O94806 1/20 0.34

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
SCHEMBL30597402 0.80 CSNK2A2 (0.36) CHEK1FLT3PLK3ALDH1A1AR
SCHEMBL3534747 0.80 TRIM24 (0.39) CHEK1FLT3PLK3MEN1ALDH1A1
SCHEMBL3607855 0.80 TRIM24 (0.50) CHEK1MEN1ALDH1A1KMT2ACYP1A2
SCHEMBL29952281 0.79 AR (0.36) CHEK1FLT3PLK3ARPARP1
SCHEMBL3362168 0.79 PIM1 (0.42) CHEK1FLT3PLK3MEN1ALDH1A1
SCHEMBL3534877 0.73 MAPT (0.48) MEN1ALDH1A1KMT2ATDP1NOS1
SCHEMBL3004142 0.73 CHEK1 (1.00) CHEK1FLT3PLK3DAOADRA2A
SCHEMBL30040295 0.73 CHEK1 (0.66) CHEK1FLT3PLK3DAOADRA2A
SCHEMBL15866141 0.73 CHEK1 (0.66) CHEK1FLT3PLK3DAOADRA2A
SCHEMBL13122682 0.72 CHEK1 (0.63) CHEK1FLT3PLK3DAOADRA2A

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-20160168140-A1 HETEROCYCLIC COMPOUNDS AS ANTIBIOTIC POTENTIATORS SYNERECA PHARMACEUTICALS (US) 2016-06-16 US disclosed
US-20160168140-A1 HETEROCYCLIC COMPOUNDS AS ANTIBIOTIC POTENTIATORS SYNERECA PHARMACEUTICALS (US) 2016-06-16 US disclosed
WO-2016094730-A1 HETEROCYCLIC COMPOUNDS AS ANTIBIOTIC POTENTIATORS SYNERECA PHARMACEUTICALS, INC. (US) 2016-06-16 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-20160168140-A1 HETEROCYCLIC COMPOUNDS AS ANTIBIOTIC POTENTIATORS FOS, FOSB, YAP1 CHEK1 1791/4885FLT3 870/4885PLK3 2491/4885

“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.