SCHEMBL5316754

SCHEMBL5316754

COC(=O)C1(C2(C(=O)OC)C(=O)CCC2=O)C(=O)CCC1=O

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
NPSR1 Q6W5P4 2/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
IL1B P01584 1/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 2/20 0.32
POLB P06746 2/20 0.32
HPGD P15428 2/20 0.32
HSD17B10 Q99714 2/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
CYP2C19 P33261 2/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
PKM P14618 1/20 0.31
TSHR P16473 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL12083389 0.78 NPSR1 (0.37) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL11063094 0.72 NPSR1 (0.31) NPSR1
SCHEMBL9308157 0.70 TP53 (0.43) NPSR1MEN1KMT2AHSD17B10GAA
SCHEMBL12083326 0.70 NPSR1 (0.36) NPSR1MEN1KMT2ACYP2C19CYP3A4
SCHEMBL1009636 0.69 CYP2C19 (0.40) NPSR1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL21114902 0.68 SMN1; SMN2 (0.38) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL24471439 0.67 LMNA (0.38) ALDH1A1NPSR1KMT2ALMNAKDM4E
SCHEMBL10046851 0.67 EED (0.42) NPSR1MEN1KMT2ASMN1; SMN2CYP2C19
SCHEMBL5352623 0.67 EED (0.42) NPSR1MEN1KMT2ASMN1; SMN2CYP2C19
SCHEMBL12083378 0.67 CYP2C19 (0.39) NPSR1MEN1KMT2ASMN1; SMN2LMNA

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-20070179222-A1 Tetrabenzodiazadiketoperylene pigments and dyes CIBA SPECIALTY CHEMICALS CORP. 2007-08-02 US disclosed
WO-2007057367-A2 TETRABENZODIAZADIKETOPERYLENE PIGMENTS FOR LASER MARKING CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-05-24 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-20070179222-A1 Tetrabenzodiazadiketoperylene pigments and dyes TYR, DDT, PAH ALDH1A1 1166/4885NPSR1 3863/4885MEN1 4104/4885

“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.