SCHEMBL20183729

SCHEMBL20183729

CCn1c(=O)cc(C2CCN(CC(F)(F)F)CC2)c2cc(C(=O)N(C)c3ccccc3)ccc21

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
OPRM1 P35372 1/20 0.37
BRD4 O60885 1/20 0.37
NR1H3 Q13133 1/20 0.36
ALDH1A1 P00352 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
POLQ O75417 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
HPGDS O60760 2/20 0.35
POLB P06746 1/20 0.35
PGR P06401 1/20 0.35
TSHR P16473 2/20 0.35
HPGD P15428 1/20 0.35
LMNA P02545 1/20 0.34
PTGER4 P35408 1/20 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
SCHEMBL20183878 0.91 KDM4E (0.46) KDM4EBRD4ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL20183528 0.89 KDM4E (0.48) KDM4EBRD4ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL20183785 0.88 KDM4E (0.43) KDM4EBRD4ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL20183682 0.87 KDM4E (0.46) KDM4EBRD4ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL20806259 0.87 GLA (0.35) KDM4EOPRM1BRD4ALDH1A1SMN1; SMN2
SCHEMBL28617147 0.87 KDM4E (0.45) KDM4EBRD4ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL20183621 0.86 KDM4E (0.46) KDM4EBRD4ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL23256500 0.86 KDM4E (0.42) KDM4EOPRM1BRD4ALDH1A1SMN1; SMN2
SCHEMBL20183549 0.86 MEN1 (0.36) ALDH1A1L3MBTL1POLBLMNA
SCHEMBL20183780 0.85 CARM1 (0.41) KDM4EBRD4ALDH1A1SMN1; SMN2LMNA

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-3563851-B1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR FUJIFILM CORP (JP) 2021-04-21 EP 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

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 KDM4E 1027/4885OPRM1 2808/4885BRD4 1/4885
US-10696637-B2 Nitrogen-containing heterocyclic compound CXCL10, CCL5, CXCR3 KDM4E 3906/4885OPRM1 623/4885BRD4 238/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 KDM4E 1027/4885OPRM1 2808/4885BRD4 1/4885
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND CXCL10, CCL5, CXCR3 KDM4E 3906/4885OPRM1 623/4885BRD4 238/4885
US-10633343-B2 CXCL10, CCL5, CXCR3 KDM4E 3627/4885OPRM1 1081/4885BRD4 496/4885

“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.