SCHEMBL4129892

SCHEMBL4129892

CS(=O)(=O)N1CC2(CCN(CC=Cc3ccc(Cl)cc3)C2)c2cc(Cl)ccc21

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 3/20 0.38
TACR1 P25103 5/20 0.38
TACR2 P21452 2/20 0.38
TACR3 P29371 2/20 0.38
DHCR7 Q9UBM7 1/20 0.37
NOTUM Q6P988 2/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 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
SCHEMBL4129887 1.00 NPY5R (0.38) NPY5RTACR1TACR2TACR3DHCR7
SCHEMBL1689678 0.79 EBP (0.39) DHCR7NOTUMPTGDR2MEN1ALDH1A1
SCHEMBL1689681 0.79 EBP (0.39) DHCR7NOTUMPTGDR2MEN1ALDH1A1
SCHEMBL1689647 0.77 NOTUM (0.64) DHCR7NOTUMPTGDR2MEN1KMT2A
SCHEMBL1689652 0.77 NOTUM (0.64) DHCR7NOTUMPTGDR2MEN1KMT2A
SCHEMBL4145410 0.74 EBP (0.38) DHCR7MEN1ALDH1A1KMT2ANPSR1
SCHEMBL4145406 0.74 EBP (0.38) DHCR7MEN1ALDH1A1KMT2ANPSR1
SCHEMBL13563961 0.74 NOTUM (0.39) TACR3DHCR7NOTUMPTGDR2MEN1
SCHEMBL4918521 0.72 EBP (0.41) DHCR7PTGDR2MEN1ALDH1A1KMT2A
SCHEMBL14303463 0.72 DRD2 (0.46) DHCR7MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846907-B2 Spiro-condensed indoline derivatives as pesticides SYNGENTA CROP PROTECTION LLC (US) 2014-09-30 US disclosed
US-20130046091-A1 SPIRO-CONDENSED INDOLINE DERIVATIVES AS PESTICIDES SYNGENTA CROP PROTECTION LLC (US) 2013-02-21 US disclosed
US-8299058-B2 Spiro-condensed indoline derivatives as pesticides SYNGENTA CROP PROTECTION LLC (US) 2012-10-30 US disclosed
US-20090042859-A1 SPIRO-CONDENSED INDOLINE DERIVATIVES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-02-12 US disclosed
EP-1697376-B1 SPIRO-CONDENSED INDOLINE DERIVATIVES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2008-06-18 EP 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 (2 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-20090042859-A1 SPIRO-CONDENSED INDOLINE DERIVATIVES AS PESTICIDES CHRM1, CHRM2, RO60 NPY5R 670/4885TACR1 90/4885TACR2 67/4885
US-20130046091-A1 SPIRO-CONDENSED INDOLINE DERIVATIVES AS PESTICIDES CHRM1, CHRM2, CHRM3 NPY5R 705/4885TACR1 82/4885TACR2 73/4885

“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.