SCHEMBL20539622

SCHEMBL20539622

Clc1cccc(CNc2nc(Cl)nc3cc(Br)ccc23)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 5/20 0.56
PDE5A O76074 2/20 0.56
PDE2A O00408 1/20 0.55
BRD4 O60885 2/20 0.54
TMIGD3 P0DMS9 1/20 0.51
HTR2C P28335 1/20 0.51
HTR2B P41595 1/20 0.51
KMT2A Q03164 3/20 0.48
MAPK1 P28482 2/20 0.46
RAF1 P04049 1/20 0.46
HTT P42858 1/20 0.46
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL30208466 1.00 APP (0.56) APPPDE5APDE2ABRD4TMIGD3
SCHEMBL18895144 0.91 BRD4 (0.61) APPPDE5APDE2ABRD4TMIGD3
SCHEMBL21055795 0.88 APP (0.72) APPPDE5AKMT2AHTTMEN1
SCHEMBL21055802 0.80 PDE5A (0.76) APPPDE5AKMT2AMEN1MAPT
SCHEMBL21055794 0.80 PDE5A (0.71) APPPDE5ABRD4KMT2AHTT
SCHEMBL18895501 0.79 APP (0.55) APPPDE5APDE2ABRD4KMT2A
SCHEMBL17557654 0.76 APP (0.57) APPPDE5ABRD4HTTSMN1; SMN2
SCHEMBL18895168 0.76 HTT (0.74) PDE5AKMT2AMAPK1RAF1HTT
SCHEMBL3638867 0.76 PDE5A (0.73) APPPDE5ABRD4KMT2AMAPT
SCHEMBL18895050 0.75 BRD4 (0.85) BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4050005-B1 BICYCLIC BET BROMODOMAIN INHIBITORS AND USES THEREOF CONVERGENE LLC (US) 2024-12-25 EP disclosed
CN-115806550-A Bicyclic BET bromodomain inhibitors and uses thereof 康威基内有限公司 2023-03-17 CN disclosed
CN-109641886-B Bicyclic BET bromodomain inhibitors and uses thereof 康威基内有限公司 2022-11-18 CN disclosed
EP-4050005-A1 BICYCLIC BET BROMODOMAIN INHIBITORS AND USES THEREOF CONVERGENE LLC (US) 2022-08-31 EP disclosed
EP-3380469-B1 BICYCLIC BET BROMODOMAIN INHIBITORS AND USES THEREOF CONVERGENE LLC (US) 2022-03-16 EP disclosed
US-11028079-B2 Small molecule BET bromodomain inhibitors and uses thereof CONVERGENE, LLC (US) 2021-06-08 US disclosed
US-20200223836-A1 SMALL MOLECULE BET BROMODOMAIN INHIBITORS AND USES THEREOF CONVERGENE LLC 2020-07-16 US disclosed
US-20180305344-A1 BICYCLIC BET BROMODOMAIN INHIBITORS AND USES THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY 2018-10-25 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-20180305344-A1 BICYCLIC BET BROMODOMAIN INHIBITORS AND USES THEREOF BRD4, BRD3, BRDT APP 1892/4885PDE5A 4425/4885PDE2A 4445/4885
US-11028079-B2 Small molecule BET bromodomain inhibitors and uses thereof BRDT, BRD4, BRD3 APP 1769/4885PDE5A 4252/4885PDE2A 4270/4885
US-20200223836-A1 SMALL MOLECULE BET BROMODOMAIN INHIBITORS AND USES THEREOF BRDT, BRD4, BRD3 APP 1769/4885PDE5A 4252/4885PDE2A 4270/4885

“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.