SCHEMBL6405817

SCHEMBL6405817

O=C(NCc1cc(CF)no1)c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
JAK2 O60674 1/20 0.47
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 1/20 0.45
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
TSHR P16473 2/20 0.44
TP53 P04637 1/20 0.44
RHOC P08134 1/20 0.43
RHOA P61586 1/20 0.43
KMT2A Q03164 5/20 0.43
MEN1 O00255 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 1/20 0.43
CYP3A4 P08684 1/20 0.42
MAPK14 Q16539 1/20 0.42
NFKB1 P19838 1/20 0.42

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
SCHEMBL6402401 0.88 POLB (0.49) POLBSMN1; SMN2JAK2ALDH1A1HTT
SCHEMBL6404074 0.88 SMN1; SMN2 (0.51) POLBSMN1; SMN2JAK2ALDH1A1HTT
SCHEMBL6401580 0.85 POLB (0.49) POLBSMN1; SMN2JAK2ALDH1A1HTT
SCHEMBL6405222 0.84 SMN1; SMN2 (0.59) POLBSMN1; SMN2JAK2ALDH1A1HTT
SCHEMBL6406614 0.79 NAMPT (0.48) POLBSMN1; SMN2L3MBTL1LMNARAB9A
SCHEMBL6407783 0.77 MLYCD (0.45) POLBSMN1; SMN2LMNATP53RHOC
SCHEMBL6403827 0.77 POLB (0.65) POLBSMN1; SMN2JAK2ALDH1A1HTT
SCHEMBL6405551 0.76 KMT2A (0.41) POLBSMN1; SMN2JAK2ALDH1A1HTT
SCHEMBL6405202 0.76 HSP90AA1 (0.47) POLBSMN1; SMN2JAK2ALDH1A1HTT
SCHEMBL6409368 0.76 TDP1 (0.52) POLBSMN1; SMN2ALDH1A1HTTL3MBTL1

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-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide SDS BIOTECH K.K. (JP) 2005-08-04 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-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide AHR, ERG28, CYP1A2 POLB 3713/4885SMN1; SMN2 4458/4885JAK2 3044/4885

“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.