SCHEMBL6764676

SCHEMBL6764676

CC(C(=O)O)N1CCC(NC(=O)Cc2ccc(Cl)cc2Cl)(C(=O)O)CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SHMT1 P34896 2/20 0.46
SHMT2 P34897 2/20 0.46
KMT2A Q03164 2/20 0.43
SIGMAR1 Q99720 1/20 0.43
P2RX7 Q99572 6/20 0.41
EPHX2 P34913 3/20 0.40
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
FABP4 P15090 1/20 0.39
FABP5 Q01469 1/20 0.39
ERCC1 P07992 2/20 0.38
ERCC4 Q92889 2/20 0.38

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
SCHEMBL6771370 0.85 SHMT1 (0.50) SHMT1SHMT2KMT2ASIGMAR1P2RX7
SCHEMBL6766382 0.85 KMT2A (0.41) KMT2ASIGMAR1P2RX7EPHX2ERCC1
SCHEMBL6766304 0.84 SHMT1 (0.48) SHMT1SHMT2KMT2ASIGMAR1P2RX7
SCHEMBL6764657 0.82 NPC1 (0.38) KMT2AP2RX7MEN1
SCHEMBL6846373 0.81 KMT2A (0.41) SHMT1SHMT2KMT2ASIGMAR1P2RX7
SCHEMBL8906957 0.81 SHMT1 (0.47) SHMT1SHMT2KMT2ASIGMAR1P2RX7
SCHEMBL6764680 0.80 SHMT1 (0.47) SHMT1SHMT2KMT2ASIGMAR1P2RX7
SCHEMBL8905439 0.79 SHMT1 (0.50) SHMT1SHMT2KMT2ASIGMAR1P2RX7
SCHEMBL6765927 0.77 ALDH1A1 (0.48) KMT2AMAPT
SCHEMBL8906080 0.77 SHMT1 (0.48) SHMT1SHMT2KMT2ASIGMAR1P2RX7

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 5 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
US-5981567-A ARTHROPODICIDAL OR NEMATICIDAL COMPOSITION BAYER AKTIENGESELLSCHAFT (DE) 1999-11-09 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 SHMT1 4483/4885SHMT2 4263/4885KMT2A 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.