SCHEMBL6482178

SCHEMBL6482178

COC(=O)C1(NC(=O)C(Cl)c2ccc(OC)cc2)CCC(C(C)(C)C)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.40
ALDH1A1 P00352 3/20 0.39
CYP2C19 P33261 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPK1 P28482 1/20 0.35
SMYD3 Q9H7B4 1/20 0.34
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
OPRK1 P41145 1/20 0.33
CNR2 P34972 1/20 0.33
GCGR P47871 1/20 0.33
SLC6A9 P48067 1/20 0.33
YAP1 P46937 1/20 0.33
TEAD4 Q15561 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL6474821 0.91 NPSR1 (0.40) NPSR1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL8886708 0.90 ADRA1D (0.34) ALDH1A1CYP2C19CYP2C9CYP3A4ATM
SCHEMBL7960983 0.88 KMT2A (0.42) NPSR1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL6474518 0.87 POLB (0.39) NPSR1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL6481442 0.86 SMYD3 (0.37) NPSR1ALDH1A1CYP2C19KMT2ACYP3A4
SCHEMBL6474830 0.85 SMYD3 (0.36) NPSR1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL6475580 0.85 MEN1 (0.41) NPSR1KMT2AMEN1CNR2RAB9A
SCHEMBL6475209 0.84 KMT2A (0.36) NPSR1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL6483593 0.83 MEN1 (0.43) NPSR1ALDH1A1CYP2C19KMT2AMEN1
SCHEMBL6481332 0.83 MEN1 (0.43) NPSR1ALDH1A1CYP2C19KMT2AMEN1

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 NPSR1 828/4885ALDH1A1 792/4885CYP2C19 428/4885

“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.