SCHEMBL15980862

SCHEMBL15980862

CC(C)NCCOCCOCCOC(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.39
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ADRB2 P07550 3/20 0.38
ADRB1 P08588 3/20 0.38
ADRB3 P13945 1/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 2/20 0.35
EPHX2 P34913 1/20 0.33
HTR1B P28222 1/20 0.33
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.32
ALOX12 P18054 1/20 0.32
NFKB1 P19838 1/20 0.32
APEX1 P27695 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL15980865 1.00 KDM4E (0.39) KDM4EPOLBTDP1ADRB2ADRB1
SCHEMBL15980866 1.00 KDM4E (0.39) KDM4EPOLBTDP1ADRB2ADRB1
SCHEMBL25053660 1.00 KDM4E (0.39) KDM4EPOLBTDP1ADRB2ADRB1
SCHEMBL21106553 1.00 KDM4E (0.39) KDM4EPOLBTDP1ADRB2ADRB1
SCHEMBL21401381 0.90 ALDH1A1 (0.40) KDM4EPOLBTDP1ADRB2ADRB1
SCHEMBL18908756 0.88 KDM4E (0.44) KDM4EPOLBTDP1ADRB2ADRB1
SCHEMBL18908660 0.88 KDM4E (0.44) KDM4EPOLBTDP1ADRB2ADRB1
SCHEMBL22930120 0.88 KDM4E (0.44) KDM4EPOLBTDP1ADRB2ADRB1
SCHEMBL22837632 0.88 KDM4E (0.44) KDM4EPOLBTDP1ADRB2ADRB1
SCHEMBL10914222 0.88 KDM4E (0.44) KDM4EPOLBTDP1ADRB2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220169660-A1 CYCLIC AMINO-PYRAZINECARBOXAMIDE COMPOUNDS AND USES THEREOF SILVERBACK THERAPEUTICS INC (US) 2022-06-02 US disclosed
WO-2021102332-A1 TGFBETAR2 INHIBITOR-LRRC15 ANTIBODY CONJUGATES AND USES THEREOF SILVERBACK THERAPEUTICS, INC. (US) 2021-05-27 WO disclosed
US-20200121684-A1 MODULATORS OF BTK PROTEOLYSIS AND METHODS OF USE UNIV YALE (US) 2020-04-23 US disclosed
US-20140243322-A1 BIVALENT BROMODOMAIN LIGANDS, AND METHODS OF USING SAME COFERON, INC. (US) 2014-08-28 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-20140243322-A1 BIVALENT BROMODOMAIN LIGANDS, AND METHODS OF USING SAME BRDT, BRD2, BRD4 KDM4E 1492/4885POLB 1099/4885TDP1 1842/4885
US-20200121684-A1 MODULATORS OF BTK PROTEOLYSIS AND METHODS OF USE BTK, CBL, CRBN KDM4E 1466/4885POLB 2875/4885TDP1 277/4885
US-20220169660-A1 CYCLIC AMINO-PYRAZINECARBOXAMIDE COMPOUNDS AND USES THEREOF TGFBR2, ACVR2A, SMAD2 KDM4E 2222/4885POLB 3264/4885TDP1 3584/4885

“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.