SCHEMBL6764668

SCHEMBL6764668

CC(=O)N1CCC(C(=O)ONC(=O)Cc2ccc(C)cc2C)CC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
MDM2 Q00987 1/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
RAB9A P51151 2/20 0.41
P2RX7 Q99572 1/20 0.40
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 3/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 2/20 0.38
EPHX2 P34913 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL6850153 0.85 ALDH1A1 (0.42) ALDH1A1MDM2KMT2AMEN1HTT
SCHEMBL7650191 0.82 P2RX7 (0.38) ALDH1A1MDM2KMT2AMEN1RAB9A
SCHEMBL6767292 0.70 MEN1 (0.44) ALDH1A1KMT2AMEN1RAB9AP2RX7
SCHEMBL9045945 0.70 MEN1 (0.42) ALDH1A1KMT2AMEN1RAB9AP2RX7
SCHEMBL6767098 0.69 MEN1 (0.49) ALDH1A1KMT2AMEN1RAB9AP2RX7
SCHEMBL2586245 0.68 ALDH1A1 (0.69) ALDH1A1MDM2KMT2AMEN1RAB9A
SCHEMBL8477754 0.68 P2RX7 (0.37) KMT2AMEN1RAB9AP2RX7HTT
SCHEMBL5537920 0.68 GRIN2B (0.63) ALDH1A1KMT2AMEN1
SCHEMBL14865223 0.66 P2RX7 (0.49) ALDH1A1KMT2AMEN1RAB9AP2RX7
SCHEMBL27416738 0.66 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2POLBEPHX2TSHR

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-6774133-B2 Substituted spiroheterocyclic 1H-3-aryl-pyrrolidine-2,4-dione derivatives, processes for their preparation, and their use as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2004-08-10 US disclosed
US-20040009999-A1 Substituted spiroheterocyclic 1H-3-aryl-pyrrolidine-2,4-dione derivatives, processes for their preparation, and their use as pesticides FISCHER REINER (DE) 2004-01-15 US disclosed
US-6555567-B1 2-oxo-3-aryl-4-hydroxy-1-aza-8-thiaspiro(4.5)decane derivatives of given formula; use as arthropodicide or nematicide BAYER AKTIENGESELLSCHAFT (DE) 2003-04-29 US disclosed
US-6479489-B1 AN ARTHROPODICIDAL OR NEMATICIDAL COMPOSITION BAYER AKTIENGESELLSCHAFT (DE) 2002-11-12 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-20040009999-A1 Substituted spiroheterocyclic 1H-3-aryl-pyrrolidine-2,4-dione derivatives, processes for their preparation, and their use as pesticides DDT, HPD, CAT ALDH1A1 382/4885MDM2 2741/4885KMT2A 1459/4885

“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.