SCHEMBL14718665

SCHEMBL14718665

O=[N+]([O-])c1cc2[nH]ncc2c(F)c1Br

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 5/20 0.50
NOS1 P29475 3/20 0.49
PIM1 P11309 2/20 0.47
TDO2 P48775 11/20 0.44
IDO1 P14902 9/20 0.44
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
CYP3A4 P08684 1/20 0.39
ALOX15 P16050 1/20 0.39
POLB P06746 1/20 0.39
MAOB P27338 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL30856077 0.80 CYP1A2 (0.51) PIM3NOS1PIM1TDO2IDO1
SCHEMBL165798 0.76 NOS1 (0.57) PIM3NOS1PIM1TDO2IDO1
SCHEMBL21873966 0.76 NOS1 (0.61) PIM3NOS1PIM1TDO2IDO1
SCHEMBL1250107 0.76 NOS1 (0.57) PIM3NOS1PIM1TDO2IDO1
SCHEMBL27216864 0.76 NOS1 (0.49) PIM3NOS1PIM1TDO2IDO1
SCHEMBL21271908 0.76 MAPT (0.42) PIM3NOS1PIM1TDO2IDO1
SCHEMBL30641196 0.76 MAPT (0.42) PIM3NOS1PIM1TDO2IDO1
SCHEMBL21271929 0.73 NOS1 (0.61) PIM3NOS1PIM1TDO2IDO1
SCHEMBL2702741 0.72 PIM3 (0.63) PIM3NOS1PIM1TDO2IDO1
SCHEMBL2215478 0.71 TDO2 (0.46) PIM3NOS1PIM1TDO2IDO1

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
WO-2025098515-A1 HETEROCYCLIC DERIVATIVES, COMPOSITIONS AND USES THEREOF DANATLAS PHARMACEUTICALS CO., LTD. (CN) 2025-05-15 WO disclosed
US-20130053382-A1 Inhibitors of Phosphoinositide Dependent Kinase 1 (PDK1) PALIWAL SUNIL (US) 2013-02-28 US disclosed
US-20130053382-A1 Inhibitors of Phosphoinositide Dependent Kinase 1 (PDK1) PALIWAL SUNIL (US) 2013-02-28 US disclosed
US-20130053382-A1 Inhibitors of Phosphoinositide Dependent Kinase 1 (PDK1) PALIWAL SUNIL (US) 2013-02-28 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-20130053382-A1 Inhibitors of Phosphoinositide Dependent Kinase 1 (PDK1) PDK1, PDPK1, PDK3 PIM3 164/4885NOS1 3945/4885PIM1 58/4885

“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.