SCHEMBL20183808

SCHEMBL20183808

CCn1c(=O)cc(C2CC2)c2cc(N(C)C(=O)c3ccccc3NS(C)(=O)=O)ccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.36
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 4/20 0.36
HSD17B10 Q99714 3/20 0.36
TSHR P16473 3/20 0.36
HPGD P15428 2/20 0.36
RORC P51449 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
KMT2A Q03164 2/20 0.35
NPY5R Q15761 1/20 0.35
HTR3E A5X5Y0 1/20 0.35
HTR3B O95264 1/20 0.35
HTR3A P46098 1/20 0.35
HTR3D Q70Z44 1/20 0.35
HTR3C Q8WXA8 1/20 0.35
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.34
NPC1 O15118 1/20 0.33
METAP2 P50579 1/20 0.33
RBP4 P02753 1/20 0.33

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
SCHEMBL20183601 0.89 NPY5R (0.38) ALDH1A1KDM4EHSD17B10TSHRHPGD
SCHEMBL20183827 0.88 MEN1 (0.39) ALDH1A1KDM4ETSHRHPGDRORC
SCHEMBL20788153 0.86 ALDH1A1 (0.40) ALDH1A1KDM4ETSHRHPGDRORC
SCHEMBL20195231 0.85 ALDH1A1 (0.35) ALDH1A1KDM4EHSD17B10TSHRHPGD
SCHEMBL20183848 0.85 NR3C2 (0.38) ALDH1A1KDM4ETSHRHPGDRORC
SCHEMBL20183494 0.85 ALDH1A1 (0.39) ALDH1A1KDM4ETSHRHPGDRORC
SCHEMBL20183481 0.85 KDM4E (0.43) ALDH1A1KDM4ETSHRHPGDRORC
SCHEMBL20183665 0.84 ALDH1A1 (0.38) ALDH1A1KDM4EHPGDRORCKMT2A
SCHEMBL20183742 0.84 ALDH1A1 (0.38) ALDH1A1KDM4EHSD17B10TSHRHPGD
SCHEMBL20183797 0.84 ALDH1A1 (0.39) ALDH1A1KDM4EHSD17B10TSHRHPGD

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 ATM 3490/4885ALDH1A1 3243/4885KDM4E 1027/4885
US-10696637-B2 Nitrogen-containing heterocyclic compound CXCL10, CCL5, CXCR3 ATM 2266/4885ALDH1A1 3095/4885KDM4E 3906/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 ATM 3490/4885ALDH1A1 3243/4885KDM4E 1027/4885
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND CXCL10, CCL5, CXCR3 ATM 2266/4885ALDH1A1 3095/4885KDM4E 3906/4885
US-10633343-B2 CXCL10, CCL5, CXCR3 ATM 2572/4885ALDH1A1 2674/4885KDM4E 3627/4885

“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.