SCHEMBL4918925

SCHEMBL4918925

O=C1CCC(=O)N1CC=Cc1ccc(-c2ccc(F)cc2)nc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
LMNA P02545 5/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
MAPT P10636 3/20 0.39
CYP11B1 P15538 2/20 0.36
CYP11B2 P19099 1/20 0.36
PTPN1 P18031 1/20 0.36
PTPN6 P29350 1/20 0.36
PTPN11 Q06124 1/20 0.36
CYP2D6 P10635 3/20 0.36
KCNH2 Q12809 3/20 0.36
HIF1A Q16665 2/20 0.36
OPRM1 P35372 2/20 0.36
HTR2A P28223 2/20 0.36
SIGMAR1 Q99720 2/20 0.36
ADRA2A P08913 2/20 0.36
ADRA2B P18089 2/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL4918921 1.00 NPC1 (0.40) NPC1RXFP1LMNAMEN1KMT2A
SCHEMBL3874170 0.95 MEN1 (0.38) NPC1RXFP1LMNAMEN1KMT2A
SCHEMBL3874171 0.95 MEN1 (0.38) NPC1RXFP1LMNAMEN1KMT2A
Trifluoroacetic Acid SCHEMBL3885351 0.91 NPC1 (0.39) NPC1RXFP1LMNAMEN1KMT2A
Trifluoroacetic Acid SCHEMBL3885352 0.91 NPC1 (0.39) NPC1RXFP1LMNAMEN1KMT2A
Trifluoroacetic Acid SCHEMBL3871750 0.87 ASIC1 (0.38) NPC1RXFP1LMNAMEN1KMT2A
Trifluoroacetic Acid SCHEMBL3871746 0.87 ASIC1 (0.38) NPC1RXFP1LMNAMEN1KMT2A
SCHEMBL4923179 0.85 NPC1 (0.33) NPC1RXFP1CYP11B1CYP11B2PTPN1
SCHEMBL4911748 0.85 NPC1 (0.39) NPC1RXFP1LMNAMEN1KMT2A
SCHEMBL4911752 0.85 NPC1 (0.39) NPC1RXFP1LMNAMEN1KMT2A

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-20080167342-A1 Heteroaryl-Substituted Amides Comprising An Unsaturated Or Cyclic Linker Group, And Their Use As Pharmaceuticals SANOFI-AVENTIS (FR) 2008-07-10 US claimed

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-20080167342-A1 Heteroaryl-Substituted Amides Comprising An Unsaturated Or Cyclic Linker Group, And Their Use As Pharmaceuticals TBXAS1, PTGIS, NOS2 NPC1 2910/4885RXFP1 708/4885LMNA 1127/4885

“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.