SCHEMBL20183589

SCHEMBL20183589

CCn1c(=O)cc(C2CC2)c2cc(-n3c(-c4ccc(C)cc4)cn(C)c3=O)ccc21

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
RAD51 Q06609 1/20 0.33
DRD2 P14416 3/20 0.32
LYN P07948 1/20 0.32
SRC P12931 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA2B P29275 1/20 0.32
SLC6A4 P31645 1/20 0.32
HTR1A P08908 6/20 0.32
HTR1B P28222 6/20 0.32
CD38 P28907 1/20 0.31
MCHR1 Q99705 1/20 0.31
KDM4E B2RXH2 1/20 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
SCHEMBL20183769 0.91 DRD2 (0.34) DRD2SLC6A4HTR1AHTR1BMCHR1
SCHEMBL20354299 0.90 HTR1A (0.33) DRD2SRCHTR1AHTR1BKDM4E
SCHEMBL20788152 0.89 AR (0.35) DRD2SLC6A4HTR1AHTR1BMCHR1
SCHEMBL20183876 0.83 TP53 (0.33) TP53RAD51DRD2LYNSRC
SCHEMBL20183530 0.80 BRD4 (0.38) KDM4E
SCHEMBL20183683 0.78 KDM4E (0.40) KDM4E
SCHEMBL21549489 0.77 KDM4E (0.43) TP53LYNSRCKDM4E
SCHEMBL20183535 0.75 MAPT (0.33) TP53DRD2SLC6A4HTR1AHTR1B
SCHEMBL20183722 0.73 AR (0.35) DRD2HTR1AHTR1BMCHR1
SCHEMBL20183526 0.72 ALDH1A1 (0.42) TP53KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10987349-B2 Antitumor agent and bromodomain inhibitor FUJIFILM CORPORATION (JP) 2021-04-27 US disclosed
EP-3327004-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND FUJIFILM CORP (JP) 2020-11-04 EP disclosed
US-10696637-B2 Nitrogen-containing heterocyclic compound FUJIFILM CORPORATION (JP) 2020-06-30 US disclosed
US-10696637-B2 Nitrogen-containing heterocyclic compound FUJIFILM CORPORATION (JP) 2020-06-30 US disclosed
US-10633343-B2 2020-04-28 US disclosed
US-10633343-B2 2020-04-28 US disclosed
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR FUJIFILM CORPORATION (JP) 2019-10-17 US disclosed
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND FUJIFILM CORPORATION (JP) 2019-03-14 US disclosed
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND FUJIFILM CORPORATION (JP) 2019-03-14 US disclosed
EP-3327004-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND Fujifilm Corporation (JP) 2018-05-30 EP 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 (5 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-10987349-B2 Antitumor agent and bromodomain inhibitor BRD4, BRD1, BRD3 TP53 94/4885RAD51 1013/4885DRD2 1322/4885
US-10696637-B2 Nitrogen-containing heterocyclic compound CXCL10, CCL5, CXCR3 TP53 1844/4885RAD51 749/4885DRD2 2443/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 TP53 94/4885RAD51 1013/4885DRD2 1322/4885
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND CXCL10, CCL5, CXCR3 TP53 1844/4885RAD51 749/4885DRD2 2443/4885
US-10633343-B2 CXCL10, CCL5, CXCR3 TP53 1821/4885RAD51 1595/4885DRD2 3407/4885

“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.