SCHEMBL17898003

SCHEMBL17898003

O=Cc1cccc(P(c2ccccc2)c2ccccc2)c1-c1c(C=O)cccc1P(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.44
LMNA P02545 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
THRB P10828 1/20 0.44
BLM P54132 1/20 0.44
CYP3A4 P08684 1/20 0.41
ERN1 O75460 4/20 0.39
ALDH1A1 P00352 4/20 0.38
DRD1 P21728 2/20 0.38
TSHR P16473 1/20 0.38
TRIM24 O15164 1/20 0.38
TRIM33 Q9UPN9 1/20 0.38
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TLR2 O60603 1/20 0.34
TLR1 Q15399 1/20 0.34
TLR6 Q9Y2C9 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
SCHEMBL705407 0.86 TDP1 (0.50) TDP1LMNAKMT2AMEN1THRB
SCHEMBL17898004 0.84 CYP2C9 (0.40) TDP1LMNAKMT2AMEN1THRB
SCHEMBL28352956 0.82 TDP1 (0.50) TDP1LMNAKMT2AMEN1THRB
SCHEMBL12446803 0.79 TDP1 (0.43) TDP1LMNAKMT2AMEN1THRB
SCHEMBL29593649 0.79 CYP3A4 (0.58) TDP1CYP3A4DRD1GAAESR1
Ethylenediamine SCHEMBL29033280 0.78 TDP1 (0.41) TDP1LMNAKMT2AMEN1THRB
Aniline SCHEMBL28503683 0.78 TDP1 (0.41) TDP1LMNAKMT2AMEN1THRB
SCHEMBL31003883 0.78 LMNA (0.41) TDP1LMNAKMT2AMEN1THRB
SCHEMBL10700827 0.73 CYP3A4 (0.50) TDP1LMNAKMT2AMEN1CYP3A4
SCHEMBL21734336 0.72 LMNA (0.60) TDP1LMNAKMT2AMEN1THRB

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-20170158703-A9 METHOD FOR PRODUCING SPIROOXINDOLE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-06-08 US disclosed
US-20160194331-A1 METHOD FOR PRODUCING SPIROOXINDOLE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2016-07-07 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-20160194331-A1 METHOD FOR PRODUCING SPIROOXINDOLE DERIVATIVE MDM2, TP53, RB1 TDP1 2527/4885LMNA 2666/4885KMT2A 3528/4885
US-20170158703-A9 METHOD FOR PRODUCING SPIROOXINDOLE DERIVATIVE MDM2, TP53, RB1 TDP1 2527/4885LMNA 2666/4885KMT2A 3528/4885

“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.