SCHEMBL3071096

SCHEMBL3071096

CC(Oc1nnc(-c2c(O)ccc3ccccc23)c2ccccc12)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SALL4 Q9UJQ4 6/20 0.40
TRIM24 O15164 1/20 0.39
TRIM33 Q9UPN9 1/20 0.39
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 3/20 0.39
MAPT P10636 2/20 0.36
GAA P10253 2/20 0.36
GLA P06280 1/20 0.36
ELANE P08246 1/20 0.35
NSD2 O96028 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
HKDC1 Q2TB90 1/20 0.35
NPSR1 Q6W5P4 2/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
AHR P35869 1/20 0.34

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
SCHEMBL3071093 1.00 SALL4 (0.40) SALL4TRIM24TRIM33MEN1KMT2A
SCHEMBL3076814 0.89 ALDH1A1 (0.41) SALL4MEN1KMT2AALDH1A1KDM4E
Biphenyl SCHEMBL27920818 0.83 HTT (0.37) MEN1KMT2AALDH1A1MAPTNPSR1
SCHEMBL27920642 0.76 HTR6 (0.32)
SCHEMBL13138599 0.74 SALL4 (0.43) SALL4TRIM24TRIM33MEN1KMT2A
SCHEMBL3079028 0.71 PTPN22 (0.43) SALL4TRIM24TRIM33ALDH1A1KDM4E
SCHEMBL22797107 0.70 SALL4 (0.42) SALL4TRIM24TRIM33MEN1KMT2A
SCHEMBL5329818 0.67 ALDH1A1 (0.50) SALL4MEN1KMT2AALDH1A1MAPT
SCHEMBL13772150 0.66 MAPT (0.45) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL19222664 0.65 MAPT (0.53) MEN1KMT2AALDH1A1KDM4EMAPT

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
CN-101098878-B Monophosphine compounds, transition metal complexes thereof and preparation of optically active compounds using the complexes as asymmetric catalysts SUMITOMO CHEMICAL CO 2013-10-16 CN disclosed
US-7790882-B2 Monophosphine compound, transition metal complex thereof and production method of optically active compound using the complex as asymmetric catalyst Carreira, Erick M. (CH) 2010-09-07 US disclosed
EP-1773853-A1 MONOPHOSPHINE COMPOUNDS, TRANSITION METAL COMPLEXES THEREOF AND PRODUCTION OF OPTICALLY ACTIVE COMPOUNDS USING THE COMPLEXES AS ASYMMETRIC CATALYSTS Sumitomo Chemical Company, Limited (JP) 2007-04-18 EP disclosed
WO-2005121157-A1 MONOPHOSPHINE COMPOUNDS, TRANSITION METAL COMPLEXES THEREOF AND PRODUCTION OF OPTICALLY ACTIVE COMPOUNDS USING THE COMPLEXES AS ASYMMETRIC CATALYSTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-12-22 WO disclosed
US-20050277772-A1 Monophosphine compound, transition metal complex thereof and production method of optically active compound using the complex as asymmetric catalyst Carreira, Erick (CH) 2005-12-15 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-20050277772-A1 Monophosphine compound, transition metal complex thereof and production method of optically active compound using the complex as asymmetric catalyst C1R, ARL1, C5 SALL4 162/4885TRIM24 3272/4885TRIM33 3144/4885

“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.