SCHEMBL6475228

SCHEMBL6475228

COc1ccc(C(Cl)C(=O)NC2(C(=O)O)CCCCCC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.45
TRPV1 Q8NER1 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CTSK P43235 6/20 0.41
SLC6A2 P23975 4/20 0.40
SLC6A4 P31645 4/20 0.40
SLC6A3 Q01959 4/20 0.40
LMNA P02545 1/20 0.40
CNR1 P21554 1/20 0.40
HTR2A P28223 1/20 0.40
HRH1 P35367 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
CNR2 P34972 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
SCHEMBL6475256 1.00 FAAH (0.45) FAAHTRPV1MEN1KMT2ACTSK
SCHEMBL6482748 1.00 FAAH (0.45) FAAHTRPV1MEN1KMT2ACTSK
SCHEMBL6483536 0.99 FAAH (0.43) FAAHTRPV1MEN1KMT2ACTSK
SCHEMBL6481332 0.90 MEN1 (0.43) FAAHTRPV1MEN1KMT2ACTSK
SCHEMBL6483593 0.90 MEN1 (0.43) FAAHTRPV1MEN1KMT2ACTSK
SCHEMBL6475365 0.90 MEN1 (0.43) FAAHTRPV1MEN1KMT2ACTSK
SCHEMBL6475580 0.88 MEN1 (0.41) FAAHTRPV1MEN1KMT2ACTSK
SCHEMBL6475744 0.86 POLB (0.39) MEN1KMT2ANPSR1CNR2
SCHEMBL8697428 0.86 GPR88 (0.47) FAAHTRPV1MEN1KMT2ACTSK
SCHEMBL8701623 0.86 GPR88 (0.47) FAAHTRPV1MEN1KMT2ACTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6939888-B2 1-H-3-arylpirrolidine-2,4-dione derivatives BAYER AKTIENGESELLSCHAFT (DE) 2005-09-06 US disclosed
US-20040019061-A1 1-H-3-arylpirrolidine-2,4-dione derivatives FISCHER REINER (DE) 2004-01-29 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-20040019061-A1 1-H-3-arylpirrolidine-2,4-dione derivatives PRXL2A, DDT, CYP4B1 FAAH 1329/4885TRPV1 2340/4885MEN1 3194/4885

“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.