SCHEMBL20183575

SCHEMBL20183575

CCn1c(=O)cc(N2CCOCC2)c2cc(-n3c(-c4ccccc4)cn(CCOC)c3=O)ccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.39
ALDH1A1 P00352 5/20 0.39
CASP1 P29466 4/20 0.39
CYP1A2 P05177 3/20 0.39
CASP7 P55210 3/20 0.39
PTGER4 P35408 2/20 0.38
KDM4E B2RXH2 4/20 0.35
USP2 O75604 1/20 0.35
POLB P06746 1/20 0.35
BRD4 O60885 4/20 0.35
HPGD P15428 2/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CCL2 P13500 1/20 0.35
BAZ2A Q9UIF9 1/20 0.35
GLO1 Q04760 1/20 0.35
LYN P07948 1/20 0.34
SRC P12931 1/20 0.34
MAPT P10636 3/20 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
SCHEMBL20354313 0.92 KDM4E (0.37) HSD17B10ALDH1A1KDM4EBRD4HPGD
SCHEMBL20183789 0.91 BRD4 (0.39) HSD17B10ALDH1A1PTGER4KDM4EBRD4
SCHEMBL20788143 0.91 KDM4E (0.38) HSD17B10ALDH1A1KDM4EBRD4HPGD
SCHEMBL20806267 0.90 KDM4E (0.38) HSD17B10ALDH1A1CASP1CYP1A2CASP7
SCHEMBL20183845 0.90 KDM4E (0.38) HSD17B10ALDH1A1PTGER4KDM4EBRD4
SCHEMBL20788145 0.89 KDM4E (0.37) HSD17B10ALDH1A1KDM4EBRD4HPGD
SCHEMBL20354312 0.89 KDM4E (0.36) HSD17B10ALDH1A1CASP1CASP7PTGER4
SCHEMBL20183610 0.83 KDM4E (0.37) HSD17B10ALDH1A1KDM4EBRD4HPGD
SCHEMBL20183530 0.80 BRD4 (0.38) HSD17B10ALDH1A1PTGER4KDM4EPOLB
SCHEMBL20183815 0.80 GAA (0.40) HSD17B10ALDH1A1KDM4EBRD4HPGD

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 14 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
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
EP-3563851-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR FUJIFILM Corporation (JP) 2019-11-06 EP disclosed
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR FUJIFILM CORPORATION (JP) 2019-10-17 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
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 HSD17B10 3331/4885ALDH1A1 3243/4885CASP1 309/4885
US-10696637-B2 Nitrogen-containing heterocyclic compound CXCL10, CCL5, CXCR3 HSD17B10 2168/4885ALDH1A1 3095/4885CASP1 760/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 HSD17B10 3331/4885ALDH1A1 3243/4885CASP1 309/4885
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND CXCL10, CCL5, CXCR3 HSD17B10 2168/4885ALDH1A1 3095/4885CASP1 760/4885
US-10633343-B2 CXCL10, CCL5, CXCR3 HSD17B10 1512/4885ALDH1A1 2674/4885CASP1 894/4885

“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.