SCHEMBL719059

SCHEMBL719059

O=S1(=O)N=C(C2CC2)Nc2cc(Cl)c(Cl)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.41
TSHR P16473 3/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP2D6 P10635 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.41
ABCC8 Q09428 2/20 0.41
KCNJ11 Q14654 2/20 0.41
CYP1A2 P05177 1/20 0.41
THRB P10828 1/20 0.41
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
NR1I2 O75469 1/20 0.33
ABCB11 O95342 1/20 0.33
ADRA2A P08913 1/20 0.33
CYP2C9 P11712 1/20 0.33
PKM P14618 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
KMT2A Q03164 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
SCHEMBL719274 0.75 CYP3A4 (0.38) CYP3A4TSHRALDH1A1CYP2D6SMN1; SMN2
SCHEMBL718987 0.73 CYP3A4 (0.71) CYP3A4TSHRALDH1A1CYP2D6SMN1; SMN2
SCHEMBL6553558 0.73 ABCC8 (0.37) CYP3A4TSHRALDH1A1CYP2D6SMN1; SMN2
SCHEMBL720876 0.72 ABCC8 (0.44) CYP3A4TSHRALDH1A1CYP2D6SMN1; SMN2
SCHEMBL717822 0.67 CYP3A4 (0.42) CYP3A4TSHRALDH1A1CYP2D6SMN1; SMN2
SCHEMBL4708802 0.66 KMT2A (0.43) CYP3A4TSHRALDH1A1CYP2D6SMN1; SMN2
SCHEMBL7951060 0.65 THRB (0.40) CYP3A4TSHRALDH1A1CYP2D6SMN1; SMN2
SCHEMBL719962 0.65 CYP3A4 (0.67) CYP3A4TSHRALDH1A1CYP2D6SMN1; SMN2
SCHEMBL30885703 0.65 CYP3A4 (0.46) CYP3A4TSHRALDH1A1CYP2D6SMN1; SMN2
SCHEMBL30885710 0.65 CYP3A4 (0.46) CYP3A4TSHRALDH1A1CYP2D6SMN1; SMN2

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-20120053172-A1 USE OF A COMBINATION OF DIAZOXIDE AND METFORMIN FOR TREATING OBESITY OR OBESITY RELATED DISORDERS COOPERATIEVE MIRZORG U.A. 2012-03-01 US disclosed
US-20100234362-A1 USE OF DIAZOXIDE FOR SUPPRESSING THE PLASMA INSULIN LEVEL IN A MAMMAL COOPERATIEVE MIRZORG U.A. (NL) 2010-09-16 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 (2 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-20120053172-A1 USE OF A COMBINATION OF DIAZOXIDE AND METFORMIN FOR TREATING OBESITY OR OBESITY RELATED DISORDERS GPR119, KCNJ1, GLP1R CYP3A4 2309/4885TSHR 891/4885ALDH1A1 1266/4885
US-20100234362-A1 USE OF DIAZOXIDE FOR SUPPRESSING THE PLASMA INSULIN LEVEL IN A MAMMAL KCNN4, KCNN1, GPR119 CYP3A4 1361/4885TSHR 1048/4885ALDH1A1 1627/4885

“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.