SCHEMBL3344729

SCHEMBL3344729

Cc1c(Cc2ccc(Cl)cc2)c(=O)n(C)c2cccc(OCC(=O)OC(C)(C)C)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41
PTPN1 P18031 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TRPC5 Q9UL62 4/20 0.37
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
KDM4E B2RXH2 2/20 0.36
PLA2G2A P14555 4/20 0.36
TDP1 Q9NUW8 1/20 0.36
HSD17B10 Q99714 2/20 0.36
TSHR P16473 1/20 0.36
POLB P06746 2/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 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
SCHEMBL3348099 0.88 HPGD (0.41) DDB1CRBNPTPN1MEN1KMT2A
SCHEMBL3345407 0.87 PLA2G2A (0.45) ALDH1A1HPGDKDM4EPLA2G2A
SCHEMBL3346117 0.80 DDB1 (0.41) DDB1CRBNPTPN1MEN1KMT2A
SCHEMBL3409928 0.79 ALDH1A1 (0.40) PTPN1MEN1KMT2ATRPC5ALDH1A1
SCHEMBL3345462 0.79 PLA2G2A (0.45) PTPN1ALDH1A1HPGDKDM4EPLA2G2A
SCHEMBL3344740 0.78 ALDH1A1 (0.39) MEN1KMT2ATRPC5ALDH1A1HPGD
SCHEMBL3345067 0.75 PPARG (0.42) TRPC5TDP1TSHRMAPT
SCHEMBL3345066 0.75 TDP1 (0.43) TRPC5ALDH1A1HPGDKDM4EPLA2G2A
SCHEMBL3349038 0.74 PTGS2 (0.37) MEN1KMT2ATRPC5ALDH1A1KDM4E
SCHEMBL3344721 0.73 P2RX3 (0.42) ALDH1A1HPGDKDM4EPLA2G2AHSD17B10

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-8236964-B2 Thiazolidine derivatives as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2012-08-07 US disclosed
US-20100113531-A1 THIAZOLIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2010-05-06 US disclosed
WO-2010040989-A1 QUINOLIN-2-ONE COMPOUNDS ARGENTA ORAL THERAPEUTICS LIMITED (GB) 2010-04-15 WO disclosed
EP-2125760-A2 THIAZOLIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS Actelion Pharmaceuticals Ltd. (CH) 2009-12-02 EP disclosed
WO-2008117241-A2 THIAZOLIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2008-10-02 WO 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-20100113531-A1 THIAZOLIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS HCRTR1, HCRTR2, NPY1R DDB1 4613/4885CRBN 2969/4885PTPN1 1249/4885

“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.