SCHEMBL20183794

SCHEMBL20183794

CCn1c(=O)cc(C2CC2)c2cc(N(C)C(=O)c3ccc(CCC4CC4)cc3)ccc21

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.38
RORC P51449 4/20 0.34
PTGER4 P35408 2/20 0.34
ALDH1A1 P00352 1/20 0.33
CNR2 P34972 4/20 0.33
NR1H4 Q96RI1 1/20 0.32
CNR1 P21554 1/20 0.32
GLA P06280 1/20 0.32
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TRPV1 Q8NER1 1/20 0.32

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
SCHEMBL20183858 0.92 NPY5R (0.39) NPY5RRORCALDH1A1GLAMAPT
SCHEMBL20183710 0.90 SMN1; SMN2 (0.37) NPY5RRORCALDH1A1GLAMAPT
SCHEMBL20183805 0.88 ALDH1A1 (0.37) NPY5RRORCPTGER4ALDH1A1MAPT
SCHEMBL20183718 0.87 NPY5R (0.34) NPY5RRORCALDH1A1CNR2CNR1
SCHEMBL20183518 0.87 BRD4 (0.39) NPY5RRORCPTGER4ALDH1A1GLA
SCHEMBL20183680 0.87 MCHR1 (0.39) NPY5RRORCPTGER4ALDH1A1KDM4E
SCHEMBL20183686 0.86 NR1H4 (0.43) NPY5RRORCPTGER4ALDH1A1NR1H4
SCHEMBL20183620 0.86 ITK (0.38) NPY5RRORCALDH1A1MAPTKDM4E
SCHEMBL20183493 0.86 MAPT (0.37) NPY5RRORCALDH1A1MAPTKDM4E
SCHEMBL20183496 0.86 ALDH1A1 (0.36) NPY5RRORCPTGER4ALDH1A1MAPT

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 15 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
WO-2018124180-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR 富士フイルム株式会社 2018-07-05 WO 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 NPY5R 1685/4885RORC 2166/4885PTGER4 3214/4885
US-10696637-B2 Nitrogen-containing heterocyclic compound CXCL10, CCL5, CXCR3 NPY5R 1196/4885RORC 2610/4885PTGER4 3686/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 NPY5R 1685/4885RORC 2166/4885PTGER4 3214/4885
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND CXCL10, CCL5, CXCR3 NPY5R 1196/4885RORC 2610/4885PTGER4 3686/4885
US-10633343-B2 CXCL10, CCL5, CXCR3 NPY5R 991/4885RORC 2295/4885PTGER4 3588/4885

“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.