SCHEMBL278950

SCHEMBL278950

CC(C)(C)[Si](C)(C)Oc1ccc(Cl)cc1C=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.42
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.38
PKM P14618 1/20 0.38
PTPN1 P18031 1/20 0.38
TSHR P16473 1/20 0.37
KMT2A Q03164 2/20 0.35
DRD2 P14416 1/20 0.34
S1PR4 O95977 1/20 0.34
XDH P47989 1/20 0.33
TTR P02766 1/20 0.33
SRC P12931 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
SCHEMBL275702 0.88 TDP1 (0.44) ERN1TDP1ALDH1A1HPGDKDM4E
SCHEMBL1070012 0.84 CA12 (0.48) ERN1TDP1ALDH1A1KDM4ETSHR
SCHEMBL28500163 0.83 PTGDR2 (0.48) ERN1TDP1ALDH1A1HPGDKDM4E
SCHEMBL2151914 0.81 ALDH1A1 (0.45) ERN1ALDH1A1HPGDKDM4EPKM
SCHEMBL279072 0.81 ERN1 (0.42) ERN1TDP1ALDH1A1HPGDKDM4E
SCHEMBL22032601 0.81 ALDH1A1 (0.40) ERN1ALDH1A1KDM4EPTPN1DRD2
SCHEMBL3510807 0.81 MAPT (0.39) TDP1ALDH1A1HPGDKDM4ETSHR
SCHEMBL4580138 0.81 CA12 (0.33) TDP1ALDH1A1HPGDKDM4ETSHR
SCHEMBL7263728 0.81 ERN1 (0.37) ERN1TDP1ALDH1A1KDM4ETSHR
SCHEMBL2458060 0.81 KMT2A (0.33) TDP1ALDH1A1KMT2ADRD2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8134001-B2 Spiroindolinone derivatives HOFFMANN-LA ROCHE INC. (US) 2012-03-13 US disclosed
US-20090156610-A1 Spiroindolinone Derivatives DING QINGJIE 2009-06-18 US disclosed
US-7495007-B2 Spiroindolinone derivatives HOFFMANN-LA ROCHE INC. (US) 2009-02-24 US disclosed
US-7495007-B2 Spiroindolinone derivatives HOFFMANN-LA ROCHE INC. (US) 2009-02-24 US disclosed
US-7495007-B2 Spiroindolinone derivatives HOFFMANN-LA ROCHE INC. (US) 2009-02-24 US disclosed
US-20080009486-A1 SPIROINDOLINONE DERIVATIVES HOFFMANN-LA ROCHE INC. 2008-01-10 US disclosed
US-20080009486-A1 SPIROINDOLINONE DERIVATIVES HOFFMANN-LA ROCHE INC. 2008-01-10 US disclosed
US-20080009486-A1 SPIROINDOLINONE DERIVATIVES HOFFMANN-LA ROCHE INC. 2008-01-10 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-20090156610-A1 Spiroindolinone Derivatives SDHA, AR, XPOT ERN1 2608/4885TDP1 3097/4885ALDH1A1 138/4885
US-20080009486-A1 SPIROINDOLINONE DERIVATIVES RB1, PKD1, KRAS ERN1 974/4885TDP1 3143/4885ALDH1A1 156/4885

“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.