SCHEMBL2071168

SCHEMBL2071168

CCOC(=O)[C@]1(NC(=O)Cc2cc(C)ccc2C)CC[C@H](OC)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.36
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 1/20 0.35
TUBA1C Q9BQE3 1/20 0.35
TUBB6 Q9BUF5 1/20 0.35
TUBB2B Q9BVA1 1/20 0.35
TUBB1 Q9H4B7 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
GRM1 Q13255 3/20 0.34
P2RX7 Q99572 1/20 0.34

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
SCHEMBL16492123 1.00 MAPK8 (0.36) MAPK8TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28745223 1.00 MAPK8 (0.36) MAPK8TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL30063229 0.92 NPC1 (0.37) MAPK8NPC1RAB9AP2RX7SMN1; SMN2
SCHEMBL12778710 0.92 NPC1 (0.37) MAPK8NPC1RAB9AP2RX7SMN1; SMN2
SCHEMBL19578935 0.92 NPC1 (0.37) MAPK8NPC1RAB9AP2RX7SMN1; SMN2
SCHEMBL16470691 0.88 NPC1 (0.39) MAPK8NPC1RAB9AP2RX7MEN1
SCHEMBL16492110 0.88 NPC1 (0.39) MAPK8NPC1RAB9AP2RX7MEN1
SCHEMBL28417615 0.88 NPC1 (0.39) MAPK8NPC1RAB9AP2RX7MEN1
SCHEMBL12845046 0.84 NPC1 (0.37) MAPK8NPC1RAB9AP2RX7MEN1
SCHEMBL19143210 0.83 NPC1 (0.38) MAPK8NPC1RAB9AP2RX7SMN1; SMN2

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-7897803-B2 Cis-alkoxy-substituted spirocyclic 1H-pyrrolidine-2,4-dione derivatives serving as pesticides BAYER CROPSCIENCE AG (DE) 2011-03-01 US disclosed
US-20100056598-A1 CIS-ALKOXY-SUBSTITUTED SPIROCYCLIC 1H-PYRROLIDINE-2,4-DIONE DERIVATIVES SERVING AS PESTICIDES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2010-03-04 US disclosed
US-7638547-B2 Cis-alkoxy-substituted spirocyclic 1H-pyrrolidine-2,4-dione derivatives serving as pesticides BAYER CROPSCIENCE AG (DE) 2009-12-29 US disclosed
US-20070032539-A1 Cis-alkoxy-substituted spirocyclic 1-h-pyrrolidine-2,4-dione derivatives serving as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-02-08 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 (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-20100056598-A1 CIS-ALKOXY-SUBSTITUTED SPIROCYCLIC 1H-PYRROLIDINE-2,4-DIONE DERIVATIVES SERVING AS PESTICIDES DDT, CYP4X1, CDY1; CDY1B MAPK8 4276/4885TUBB4A 1149/4885TUBB 1096/4885
US-20070032539-A1 Cis-alkoxy-substituted spirocyclic 1-h-pyrrolidine-2,4-dione derivatives serving as pesticides DDT, CYP4X1, PDHX MAPK8 4118/4885TUBB4A 1531/4885TUBB 1268/4885

“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.