SCHEMBL7690984

SCHEMBL7690984

CN1C2CC(O)C1CC(C#N)(c1cccnc1)C2

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.36
HSD11B1 P28845 1/20 0.36
OPRL1 P41146 4/20 0.34
OPRM1 P35372 3/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 1/20 0.34
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
HTT P42858 1/20 0.33
CYP2C19 P33261 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL7230273 0.81 OPRL1 (0.44) NPSR1HSD11B1OPRL1OPRM1ALDH1A1
SCHEMBL7689219 0.81 CHRNB2 (0.32) MEN1KMT2A
SCHEMBL7686941 0.81 CHRNB2 (0.34) OPRL1MEN1KMT2A
SCHEMBL22629246 0.77 HSD11B1 (0.40) NPSR1HSD11B1OPRL1OPRM1ALDH1A1
SCHEMBL7688352 0.76 HSD11B1 (0.39) NPSR1HSD11B1OPRL1OPRM1CHRM2
SCHEMBL7228426 0.76 GAA (0.44) NPSR1HSD11B1OPRL1OPRM1ALDH1A1
SCHEMBL7221945 0.74 SMN1; SMN2 (0.41) NPSR1HSD11B1OPRL1ALDH1A1GAA
SCHEMBL7689198 0.74 MEN1 (0.30) MEN1KMT2A
SCHEMBL7229908 0.71 NPSR1 (0.40) NPSR1HSD11B1OPRL1OPRM1ALDH1A1
SCHEMBL22629830 0.71 HSD11B1 (0.40) NPSR1HSD11B1OPRL1OPRM1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020061913-A1 Bicyclic amine derivatives SYNGENTA LIMITED (GB) 2002-05-23 US disclosed
US-6291474-B1 COMBATING AND CONTROLLING INSECT, ACARINE OR NEMATODE PESTS ZENECA LIMITED (GB) 2001-09-18 US disclosed
US-6177442-B1 INSECTICIDES; PESTICIDES; MITICIDES; NEMATOCIDES ZENECA LIMITED (GB) 2001-01-23 US disclosed
US-5968947-A INSECTICIDES, ACARICIDES, NEMATOCIDES ZENECA LIMITED (GB) 1999-10-19 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-20020061913-A1 Bicyclic amine derivatives ADRA1D, TAAR1, ADRA1A NPSR1 231/4885HSD11B1 1948/4885OPRL1 497/4885

“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.