SCHEMBL23947124

SCHEMBL23947124

COc1cccc(Br)c1-c1ccnc(Cl)c1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 4/20 0.40
HSP90AB1 P08238 3/20 0.40
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
HTT P42858 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
LMNA P02545 1/20 0.37
PKM P14618 2/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
KLF5 Q13887 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DYRK1A Q13627 3/20 0.34
HTR7 P34969 2/20 0.34
DHPS P49366 2/20 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
SCHEMBL2541138 0.78 HSP90AA1 (0.47) HSP90AA1HSP90AB1RAB9AKDM4EMAPT
SCHEMBL23946599 0.75 PLAU (0.42) HSP90AA1HSP90AB1RAB9AHTTLMNA
SCHEMBL25608297 0.75 HSP90AA1 (0.40) HSP90AA1HSP90AB1MAPTTDP1ALDH1A1
SCHEMBL23947339 0.74 CA1 (0.39) HSP90AA1HSP90AB1RAB9AKDM4EMAPT
SCHEMBL23947559 0.73 HSP90AA1 (0.47) HSP90AA1HSP90AB1RAB9AKDM4EMAPT
SCHEMBL23946680 0.71 CYP1A2 (0.43) HSP90AA1HSP90AB1TDP1ALDH1A1GAA
SCHEMBL1760983 0.71 DYRK1A (0.45) RAB9AKDM4EMAPTHTTTDP1
SCHEMBL30832982 0.71 ALDH1A1 (0.52) RAB9AKDM4EMAPTHTTTDP1
SCHEMBL23947250 0.70 KMT2A (0.43) HSP90AA1HSP90AB1KDM4ETDP1L3MBTL1
SCHEMBL1768355 0.70 TOP1 (0.47) RAB9AKDM4EMAPTHTTTDP1

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-20230174544-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2023-06-08 US disclosed
US-20230174544-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2023-06-08 US disclosed
WO-2021210911-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-10-21 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 (1 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-20230174544-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY2, CYBA, AHR HSP90AA1 4526/4885HSP90AB1 4323/4885RAB9A 2348/4885

“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.