SCHEMBL6475230

SCHEMBL6475230

COc1ccc(CC(=O)NC2(C(=O)O)CCCCC2C)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 5/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
P2RX7 Q99572 2/20 0.40
HPGD P15428 2/20 0.38
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
TSHR P16473 2/20 0.37
EPHX2 P34913 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
SSTR3 P32745 1/20 0.36

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
SCHEMBL6475250 0.92 MEN1 (0.45) MEN1KMT2AALDH1A1THRBHTT
SCHEMBL7960270 0.89 ALDH1A1 (0.48) MEN1KMT2AALDH1A1HPGDAPOBEC3A
SCHEMBL8907562 0.87 SIGMAR1 (0.44) KMT2AP2RX7EPHX2SIGMAR1
SCHEMBL8650736 0.86 NPC1 (0.38) KMT2AL3MBTL1P2RX7SIGMAR1
SCHEMBL6481367 0.84 MEN1 (0.45) MEN1KMT2AALDH1A1HPGDFFAR4
SCHEMBL6483531 0.82 SHMT1 (0.43) MEN1KMT2AALDH1A1THRBHTT
SCHEMBL8907113 0.81 KMT2A (0.41) MEN1KMT2AALDH1A1THRBHTT
SCHEMBL8657819 0.81 P2RX7 (0.42) KMT2AP2RX7HPGDSIGMAR1
SCHEMBL6475252 0.81 MEN1 (0.45) MEN1KMT2AALDH1A1THRBHTT
SCHEMBL6475226 0.81 MEN1 (0.45) MEN1KMT2AALDH1A1THRBHTT

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 3 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
US-6472419-B1 1-H-3-aryl-pyrrolidine-2, 4-dione derivatives as pest-control agents BAYER AKTIENGESELLSCHAFT (DE) 2002-10-29 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 MEN1 3194/4885KMT2A 2190/4885ALDH1A1 792/4885

“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.