SCHEMBL21298099

SCHEMBL21298099

c1ccc2cc3c(cc2c1)c1cccnc1n1cc2ccccc2c31

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.40
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 4/20 0.38
HPGD P15428 1/20 0.38
CYP3A4 P08684 2/20 0.35
HTR6 P50406 2/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR7 P34969 1/20 0.33
DRD3 P35462 1/20 0.33
CCR1 P32246 2/20 0.33
CCR8 P51685 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CCNT1 O60563 1/20 0.32
PIM1 P11309 1/20 0.32
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
CDK9 P50750 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
SCHEMBL21917740 0.89 KDM4E (0.40) DYRK1AKDM4EALDH1A1HPGDCYP3A4
SCHEMBL21791080 0.83 ALDH1A1 (0.34) DYRK1AKDM4EALDH1A1CCR1CCR8
SCHEMBL21298302 0.79 CYP3A4 (0.40) DYRK1AKDM4EALDH1A1HPGDCYP3A4
SCHEMBL21791081 0.79 ALDH1A1 (0.40) DYRK1AKDM4EALDH1A1HPGDCYP3A4
SCHEMBL21298396 0.79 CYP3A4 (0.40) DYRK1AKDM4EALDH1A1HPGDCYP3A4
SCHEMBL21297873 0.78 ALDH1A1 (0.38) DYRK1AKDM4EALDH1A1HPGDCYP3A4
SCHEMBL21298139 0.78 KDM4E (0.44) KDM4EALDH1A1HPGDL3MBTL1MEN1
SCHEMBL21298102 0.75 ALDH1A1 (0.34) KDM4EALDH1A1HPGDCNR1CNR2
SCHEMBL21298540 0.75 ALDH1A1 (0.34) KDM4EALDH1A1TSHRCYP1A2
SCHEMBL21298541 0.75 ALDH1A1 (0.43) KDM4EALDH1A1HTR2AHTR2CCYP2C19

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-20230192695-A1 THERMALLY ASSISTED DELAYED FLUORESCENT MATERIALS WITH TRIAD-TYPE MATERIALS UNIV ARIZONA STATE (US) 2023-06-22 US disclosed
US-20230192695-A1 THERMALLY ASSISTED DELAYED FLUORESCENT MATERIALS WITH TRIAD-TYPE MATERIALS UNIV ARIZONA STATE (US) 2023-06-22 US disclosed
US-20210024526-A1 THERMALLY ASSISTED DELAYED FLUORESCENT MATERIALS WITH TRIAD-TYPE MATERIALS UNITED STATES DEPARTMENT OF ENERGY 2021-01-28 US disclosed
US-20200071330-A1 THERMALLY ASSISTED DELAYED FLUORESCENT MATERIALS WITH TRIAD-TYPE MATERIALS UNITED STATES DEPARTMENT OF ENERGY 2020-03-05 US disclosed
US-10392387-B2 Substituted benzo[4,5]imidazo[1,2-a]phenanthro[9,10-c][1,8]naphthyridines, benzo[4,5]imidazo[1,2-a]phenanthro[9,10-c][1,5]naphthyridines and dibenzo[f,h]benzo[4,5]imidazo[2,1-a]pyrazino[2,3-c]isoquinolines as thermally assisted delayed fluorescent materials ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2019-08-27 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 (4 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-20210024526-A1 THERMALLY ASSISTED DELAYED FLUORESCENT MATERIALS WITH TRIAD-TYPE MATERIALS TTPA, TTC14, AAAS DYRK1A 3633/4885KDM4E 3740/4885ALDH1A1 2839/4885
US-20200071330-A1 THERMALLY ASSISTED DELAYED FLUORESCENT MATERIALS WITH TRIAD-TYPE MATERIALS TTPA, TTC14, AAAS DYRK1A 3633/4885KDM4E 3740/4885ALDH1A1 2839/4885
US-20230192695-A1 THERMALLY ASSISTED DELAYED FLUORESCENT MATERIALS WITH TRIAD-TYPE MATERIALS TTPA, TTC14, AAAS DYRK1A 3633/4885KDM4E 3740/4885ALDH1A1 2839/4885
US-10392387-B2 Substituted benzo[4,5]imidazo[1,2-a]phenanthro[9,10-c][1,8]naphthyridines, benzo[4,5]imidazo[1,2-a]phenanthro[9,10-c][1,5]naphthyridines and dibenzo[f,h]benzo[4,5]imidazo[2,1-a]pyrazino[2,3-c]isoquinolines as thermally assisted delayed fluorescent materials NT5C, HTR3D, IK DYRK1A 4102/4885KDM4E 2046/4885ALDH1A1 326/4885

“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.