SCHEMBL20030165

SCHEMBL20030165

c1ccc(-c2nc(-c3cccc4ccccc34)nc3c2oc2ccc(-c4ccc5c(c4)c4c6ccccc6ccc4n5-c4ccccc4)cc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.37
CSNK2A2 P19784 1/20 0.37
CSNK2B P67870 1/20 0.37
PIM3 Q86V86 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
SIRT2 Q8IXJ6 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
ALDH1A1 P00352 9/20 0.34
MAPT P10636 5/20 0.34
CYP1A1 P04798 1/20 0.32
CYP1A2 P05177 1/20 0.32
FYN P06241 1/20 0.32
MAPK3 P27361 1/20 0.32
AHR P35869 1/20 0.32
PAX8 Q06710 1/20 0.32
ABCG2 Q9UNQ0 1/20 0.32
HPGD P15428 4/20 0.32
TSHR P16473 4/20 0.32
KDM4E B2RXH2 5/20 0.31
HSD17B10 Q99714 2/20 0.31

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
SCHEMBL20030163 0.96 SIRT2 (0.36) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL20030153 0.93 ALDH1A1 (0.37) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL20030152 0.90 ALDH1A1 (0.35) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL18273196 0.89 TSHR (0.38) ALDH1A1MAPTCYP1A2HPGDTSHR
SCHEMBL27363968 0.88 PIM1 (0.38) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL20029894 0.88 PIM1 (0.37) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL27363995 0.87 PIM1 (0.34) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL24118999 0.87 PIM1 (0.35) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL18273220 0.86 ALDH1A1 (0.37) SIRT2SIRT1ALDH1A1MAPTCYP1A2
SCHEMBL18273195 0.86 TSHR (0.38) ALDH1A1MAPTCYP1A2HPGDTSHR

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
US-12030890-B2 Compounds with diazadibenzofurane or diazadibenzothiophene structures MERCK PATENT GMBH (DE) 2024-07-09 US disclosed
US-12030890-B2 Compounds with diazadibenzofurane or diazadibenzothiophene structures MERCK PATENT GMBH (DE) 2024-07-09 US disclosed
US-11530224-B2 Compounds with diazadibenzofurane or diazadibenzothiophene structures MERCK PATENT GMBH (DE) 2022-12-20 US disclosed
EP-3519417-B1 COMPOUNDS WITH DIAZADIBENZOFURANE OR DIAZADIBENZOTHIOPHENE STRUCTURES MERCK PATENT GMBH (DE) 2021-09-08 EP disclosed
WO-2018060307-A1 COMPOUNDS WITH DIAZADIBENZOFURANE OR DIAZADIBENZOTHIOPHENE STRUCTURES MERCK PATENT GMBH (DE) 2018-04-05 WO 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-12030890-B2 Compounds with diazadibenzofurane or diazadibenzothiophene structures DDT, ESD, DBF4 PIM1 344/4885CSNK2A2 4573/4885CSNK2B 4537/4885
US-11530224-B2 Compounds with diazadibenzofurane or diazadibenzothiophene structures DDT, ESD, DBF4 PIM1 344/4885CSNK2A2 4573/4885CSNK2B 4537/4885

“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.