SCHEMBL7082774

SCHEMBL7082774

N#C/C(C(=O)c1ccc(NS(=O)(=O)C(F)(F)F)cc1)=C1\CCCCN1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.59
NPC1 O15118 1/20 0.59
HPGD P15428 1/20 0.59
RAB9A P51151 1/20 0.59
MAPK1 P28482 2/20 0.55
MEN1 O00255 1/20 0.55
MAPT P10636 1/20 0.55
TSHR P16473 1/20 0.55
KMT2A Q03164 1/20 0.55
PPARA Q07869 5/20 0.44
PPARG P37231 1/20 0.38
PTPN1 P18031 1/20 0.36
CA2 P00918 2/20 0.36
PTPN11 Q06124 1/20 0.36
CA1 P00915 1/20 0.33
PTGS1 P23219 2/20 0.32
EPHX2 P34913 1/20 0.31
SLC22A12 Q96S37 1/20 0.31
HSPD1 P10809 1/20 0.31
HSPE1 P61604 1/20 0.31

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
SCHEMBL7082776 1.00 SMN1; SMN2 (0.59) SMN1; SMN2NPC1HPGDRAB9AMAPK1
SCHEMBL7086102 0.77 MEN1 (0.69) SMN1; SMN2NPC1HPGDRAB9AMAPK1
SCHEMBL6172393 0.77 MEN1 (0.69) SMN1; SMN2NPC1HPGDRAB9AMAPK1
SCHEMBL7079886 0.76 NPC1 (0.73) SMN1; SMN2NPC1HPGDRAB9AMAPK1
SCHEMBL6169261 0.76 NPC1 (0.73) SMN1; SMN2NPC1HPGDRAB9AMAPK1
SCHEMBL7085153 0.74 MEN1 (0.64) SMN1; SMN2NPC1HPGDRAB9AMAPK1
SCHEMBL6171653 0.74 MEN1 (0.64) SMN1; SMN2NPC1HPGDRAB9AMAPK1
SCHEMBL6168784 0.73 NPC1 (0.68) SMN1; SMN2NPC1HPGDRAB9AMAPK1
SCHEMBL7086417 0.72 MAPT (0.74) SMN1; SMN2NPC1HPGDRAB9AMAPK1
SCHEMBL6172072 0.72 MAPT (0.74) SMN1; SMN2NPC1HPGDRAB9AMAPK1

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-20030130125-A1 Phenyl-substituted cyclic enaminones FISCHER REINER (DE) 2003-07-10 US disclosed
US-6455472-B1 HERBICIDES, ACARICIDES, NEMATICIDES AND INSECTICIDES FOR CROPS BAYER AKTIENGESELLSCHAFT (DE) 2002-09-24 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-20030130125-A1 Phenyl-substituted cyclic enaminones DDT, CYP19A1, KCNA1 SMN1; SMN2 3366/4885NPC1 3964/4885HPGD 2376/4885

“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.