SCHEMBL14768892

SCHEMBL14768892

CON1CCC(C#N)(N(C(=O)Cc2c(C)cc(C)cc2C)N2CCOCC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
POLB P06746 2/20 0.33
RAB9A P51151 2/20 0.32
KDM4E B2RXH2 2/20 0.32
NPC1 O15118 1/20 0.32
GLA P06280 1/20 0.32
HPGD P15428 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL14768894 0.93 RAB9A (0.34) POLBRAB9A
SCHEMBL12456817 0.88 ALDH1A1 (0.35) ALDH1A1MAPTMAPK1POLBRAB9A
SCHEMBL14768882 0.86 L3MBTL1 (0.35) ALDH1A1MAPTRAB9AKDM4ENPC1
SCHEMBL12574771 0.85 ALDH1A1 (0.36) ALDH1A1MAPTMAPK1POLBRAB9A
SCHEMBL12574767 0.83 MAPT (0.34) ALDH1A1MAPTMAPK1POLBRAB9A
SCHEMBL37429 0.82 RXFP1 (0.35)
SCHEMBL1959599 0.81
SCHEMBL15032130 0.80 MEN1 (0.32) MEN1KMT2A
SCHEMBL15032132 0.79 MEN1 (0.35) ALDH1A1MAPK1HPGDMEN1KMT2A
SCHEMBL12574772 0.78 RAB9A (0.36) ALDH1A1MAPK1POLBRAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130065756-A1 SPIROHETEROCYCLIC DIONE DERIVATIVES USED AS PESTICIDES SYNGENTA CROP PROTECTION LLC (US) 2013-03-14 US disclosed
US-20130065756-A1 SPIROHETEROCYCLIC DIONE DERIVATIVES USED AS PESTICIDES SYNGENTA CROP PROTECTION LLC (US) 2013-03-14 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-20130065756-A1 SPIROHETEROCYCLIC DIONE DERIVATIVES USED AS PESTICIDES DDT, PKD2, PKD1 ALDH1A1 154/4885MAPT 4692/4885MAPK1 2534/4885

“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.