SCHEMBL10164938

SCHEMBL10164938

CCON1CCC(C#N)(NC(=O)Cc2cc(C)ccc2C)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
P2RX7 Q99572 2/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 2/20 0.34
CTSL P07711 2/20 0.34
RXFP1 Q9HBX9 1/20 0.34
CTSS P25774 1/20 0.34
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL10164748 0.89 MAPK8 (0.41) MAPK8SMN1; SMN2NPC1RAB9AP2RX7
SCHEMBL247704 0.84 HDAC3 (0.34) NPC1P2RX7ALDH1A1CTSLRXFP1
SCHEMBL10164591 0.82 MAPK8 (0.36) MAPK8SMN1; SMN2NPC1RAB9AP2RX7
SCHEMBL10164756 0.80 KMT2A (0.42) P2RX7ALDH1A1KMT2A
SCHEMBL6764658 0.77 MEN1 (0.42) NPC1RAB9AP2RX7ALDH1A1TP53
SCHEMBL11888076 0.76 MAPK8 (0.40) MAPK8SMN1; SMN2NPC1RAB9AP2RX7
SCHEMBL6767098 0.75 MEN1 (0.49) NPC1RAB9AP2RX7ALDH1A1CTSL
SCHEMBL8862910 0.74 RXFP1 (0.45) NPC1RAB9AALDH1A1RXFP1KMT2A
SCHEMBL13884156 0.73 MAPK8 (0.39) MAPK8SMN1; SMN2NPC1RAB9AP2RX7
SCHEMBL8862680 0.73 RXFP1 (0.47) NPC1ALDH1A1RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2197844-B1 SPIROHETEROCYCLIC PYRROLIDINE DIONE DERIVATIVES USEFUL AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2012-07-25 EP disclosed
US-20120035201-A1 SPIROHETEROCYCLIC PYRROLIDINE DIONE DERIVATIVES USED AS PESTICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-09 US disclosed
US-20100311777-A1 SPIROHETEROCYCLIC PYRROLIDINE DIONE DERIVATIVES USEFUL AS PESTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-12-09 US disclosed
US-20100311777-A1 SPIROHETEROCYCLIC PYRROLIDINE DIONE DERIVATIVES USEFUL AS PESTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-12-09 US disclosed
WO-2010115780-A1 SPIROHETEROCYCLIC PYRROLIDINE DIONE DERIVATIVES USED AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-10-14 WO disclosed
WO-2009049851-A1 SPIROHETEROCYCLIC PYRROLIDINE DIONE DERIVATIVES USEFUL AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-04-23 WO 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-20100311777-A1 SPIROHETEROCYCLIC PYRROLIDINE DIONE DERIVATIVES USEFUL AS PESTICIDES DDT, PKD2, PKD1 MAPK8 3963/4885SMN1; SMN2 3146/4885NPC1 3498/4885
US-20120035201-A1 SPIROHETEROCYCLIC PYRROLIDINE DIONE DERIVATIVES USED AS PESTICIDES DDT, PKD2, PKD1 MAPK8 4173/4885SMN1; SMN2 2581/4885NPC1 2090/4885

“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.