SCHEMBL19255837

SCHEMBL19255837

CC(C)(C)OC(=O)NCCCCCN1C(=O)C=CC1O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.49
DRD2 P14416 7/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
CACNA1G O43497 3/20 0.43
MAN2B1 O00754 1/20 0.43
CA12 O43570 4/20 0.41
CA1 P00915 4/20 0.41
CA2 P00918 4/20 0.41
CA9 Q16790 4/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL20968680 0.90 NFKB1 (0.43) TDP1DRD2MAN2B1MEN1GAA
SCHEMBL20228106 0.84 NFKB1 (0.39) TDP1DRD2CA12CA1CA2
SCHEMBL19703902 0.81 EPHX1 (0.33) DRD2
SCHEMBL17738032 0.79 TDP1 (0.56) TDP1DRD2MAOAMAOBCA12
SCHEMBL28508194 0.79 TDP1 (0.56) TDP1DRD2MAOAMAOBCA12
SCHEMBL7801592 0.79 TDP1 (0.56) TDP1DRD2MAOAMAOBCA12
SCHEMBL19703886 0.78 HTT (0.36) MEN1GAAKMT2A
SCHEMBL1449045 0.78 TDP1 (0.54) TDP1DRD2MAOAMAOBCA12
SCHEMBL22419937 0.77 PLK1 (0.41) CA12CA1CA2CA9
SCHEMBL27317330 0.77 TDP1 (0.56) TDP1DRD2MAOAMAOBMAN2B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10556895-B2 Quaternary amine compounds and antibody-drug conjugates thereof GENENTECH, INC. (US) 2020-02-11 US disclosed
US-10017577-B2 Antibodies and immunoconjugates GENENTECH, INC. (US) 2018-07-10 US disclosed
US-20170232113-A1 QUATERNARY AMINE COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF GENENTECH, INC. (US) 2017-08-17 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 (3 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-10017577-B2 Antibodies and immunoconjugates FCGR3B, CD47, FCGR1A TDP1 4264/4885DRD2 2925/4885MAOA 3283/4885
US-20170232113-A1 QUATERNARY AMINE COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF H1-5, H1-4, CD47 TDP1 872/4885DRD2 521/4885MAOA 762/4885
US-10556895-B2 Quaternary amine compounds and antibody-drug conjugates thereof H1-5, H1-4, CD47 TDP1 872/4885DRD2 521/4885MAOA 762/4885

“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.