SCHEMBL1997435

SCHEMBL1997435

O=C(c1ccnc(Cl)c1)N1CC2(CCNCC2)c2ncc(Cl)cc21

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PROKR1 Q8TCW9 8/20 0.40
TACR3 P29371 1/20 0.39
PDE4B Q07343 1/20 0.33
GFER P55789 1/20 0.33
SLC6A3 Q01959 1/20 0.32
KCNH2 Q12809 1/20 0.32
TAAR1 Q96RJ0 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
SCHEMBL1998171 0.86 GABRD (0.35) PROKR1TACR3GFERSLC6A3KCNH2
SCHEMBL1689732 0.82 NOTUM (0.51) PROKR1TACR3
SCHEMBL10253494 0.81 NOTUM (0.44) PDE4B
Hydrochloric Acid SCHEMBL2351254 0.80 AKT1 (0.42) PROKR1PDE4B
SCHEMBL19444822 0.78 GABRD (0.39) PROKR1TACR3PDE4BGFER
Trifluoroacetic Acid SCHEMBL1689684 0.77 HDAC1 (0.42) PDE4B
SCHEMBL1993910 0.76 KCNH2 (0.36) PROKR1TACR3GFERKCNH2
SCHEMBL14675951 0.75 PDE4B (0.36) PROKR1PDE4B
SCHEMBL6002545 0.74 NR1H2 (0.35)
SCHEMBL4256792 0.70 PROKR1 (0.43) PROKR1TACR3GFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960401-B2 Spiropiperidine derivatives for controlling pests SYNGENTA CROP PROTECTION, INC. (US) 2011-06-14 US disclosed
EP-1694677-B1 SPIROPIPERIDINE DERIVATIVES FOR CONTROLLING PESTS SYNGENTA PARTICIPATIONS AG (CH) 2009-12-02 EP disclosed
US-20070135408-A1 Spiropiperidine derivatives for controlling pests SYNGENTA CROP PROTECTION, INC. 2007-06-14 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-20070135408-A1 Spiropiperidine derivatives for controlling pests CHRM1, CHRM2, RER1 PROKR1 1330/4885TACR3 110/4885PDE4B 1119/4885

“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.