SCHEMBL17427352

SCHEMBL17427352

Cn1nc(C(=O)O)c(=O)n(-c2ccccc2F)c1=O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 4/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KDM4E B2RXH2 2/20 0.39
HSP90AA1 P07900 1/20 0.38
LMNA P02545 1/20 0.38
HCAR1 Q9BXC0 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HPD P32754 1/20 0.38
POLB P06746 1/20 0.37
PKM P14618 1/20 0.37
TP53 P04637 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
SCHEMBL16022003 0.92 HCAR1 (0.40) NOTUMSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL17427362 0.88 L3MBTL1 (0.47) NOTUMSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL17427353 0.85 KDM4E (0.49) NOTUMSMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL248654 0.81 GSK3A (0.47) SMN1; SMN2NPC1RAB9AALDH1A1KMT2A
SCHEMBL17430272 0.81 NPSR1 (0.56) SMN1; SMN2NPC1RAB9AALDH1A1KMT2A
SCHEMBL246360 0.81 KDM4E (0.45) NOTUMSMN1; SMN2ALDH1A1KMT2AGAA
SCHEMBL14966907 0.78 KMT2A (0.49) NOTUMSMN1; SMN2NPC1KMT2AKDM4E
SCHEMBL16022130 0.77 GRM4 (0.43) NOTUMKMT2AMEN1LMNA
SCHEMBL17427356 0.77 POLB (0.48) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL17427364 0.73 ALDH1A1 (0.41) NOTUMALDH1A1GAAKDM4ELMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160009693-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2016-01-14 US disclosed
US-20160009693-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2016-01-14 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-20160009693-A1 HERBICIDAL COMPOUNDS DDT, HAX1, CYP4X1 NOTUM 166/4885SMN1; SMN2 4026/4885NPC1 4146/4885

“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.