SCHEMBL6765400

SCHEMBL6765400

CC(C(=O)O)N1CCC(C#N)(NC(=O)Cc2c(F)cccc2Cl)CC1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
KMT2A Q03164 2/20 0.42
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 2/20 0.39
P2RX7 Q99572 1/20 0.39

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
SCHEMBL6762505 0.93 CTSL (0.41) ALDH1A1KMT2ANPC1RAB9A
SCHEMBL6771072 0.86 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2KMT2AMAPTNPSR1
SCHEMBL6765927 0.85 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2KMT2AMAPTNPSR1
SCHEMBL6762138 0.84 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2KMT2AMAPTNPSR1
SCHEMBL6765402 0.82 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2KMT2AMAPTNPSR1
SCHEMBL6766382 0.78 KMT2A (0.41) KMT2AP2RX7
SCHEMBL6850941 0.78 ALDH1A1 (0.47) ALDH1A1KMT2ANPC1RAB9A
SCHEMBL6771442 0.78 CTSL (0.39) ALDH1A1NPC1
SCHEMBL6846373 0.77 KMT2A (0.41) ALDH1A1KMT2AP2RX7
SCHEMBL6765253 0.76 CTSS (0.42) ALDH1A1KMT2AMAPTKDM4E

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 ALDH1A1 382/4885SMN1; SMN2 3044/4885KMT2A 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.