SCHEMBL6810057

SCHEMBL6810057

CC1CC(C)CC(C(=O)NCC(N)=O)C1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.35
CHRNA4 P43681 3/20 0.35
CHRNA7 P36544 2/20 0.35
CHRNB4 P30926 2/20 0.35
CHRNA3 P32297 2/20 0.35
FPR3 P25089 1/20 0.33
FPR2 P25090 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PSMB5 P28074 1/20 0.30
KDM1A O60341 1/20 0.30
USP2 O75604 1/20 0.30
TSHR P16473 1/20 0.30
EPHX1 P07099 1/20 0.30

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
SCHEMBL6809254 1.00 CHRNB2 (0.35) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL6267443 1.00 CHRNB2 (0.35) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL6273756 0.82 AAK1 (0.43) SMN1; SMN2HSD17B10PSMB5USP2EPHX1
SCHEMBL6271562 0.81 CHRNB2 (0.40) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL6809163 0.81 CHRNB2 (0.40) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL6271761 0.81 KMT2A (0.41) SMN1; SMN2HSD17B10PSMB5EPHX1
SCHEMBL6813554 0.79 FPR3 (0.38) FPR3FPR2
SCHEMBL6274769 0.79 FPR3 (0.38) FPR3FPR2
SCHEMBL6274792 0.77 AAK1 (0.40) SMN1; SMN2HSD17B10PSMB5USP2TSHR
SCHEMBL20177411 0.77 PREP (0.33) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3

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-20040077618-A1 Cycloalkylamides and their therapeutic applications ABBOTT LABORATORIES 2004-04-22 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-20040077618-A1 Cycloalkylamides and their therapeutic applications GAP43, SCN1B, GRIN2B CHRNB2 170/4885CHRNA4 191/4885CHRNA7 149/4885

“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.