SCHEMBL20183703

SCHEMBL20183703

CCn1c(=O)cc(C)c2cc(N(C)C(=O)c3cccs3)ccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
NPY5R Q15761 1/20 0.40
THRB P10828 1/20 0.40
KDM4E B2RXH2 5/20 0.39
POLB P06746 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
HSD17B10 Q99714 1/20 0.39
INSR P06213 1/20 0.39
ITK Q08881 1/20 0.39
ALDH1A1 P00352 4/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 2/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL20183706 0.81 INSR (0.41) NPY5RTHRBKDM4EPOLBL3MBTL1
SCHEMBL20183642 0.79 KDM4E (0.39) NPY5RKDM4EPOLBL3MBTL1HSD17B10
SCHEMBL20183863 0.76 KDM4E (0.47) THRBKDM4EPOLBL3MBTL1HSD17B10
SCHEMBL20183643 0.75 HSD17B1 (0.49) THRBKDM4EPOLBL3MBTL1HSD17B10
SCHEMBL20183747 0.74 KDM4E (0.37) NPY5RKDM4EPOLBL3MBTL1HSD17B10
SCHEMBL20183719 0.71 KDM4E (0.44) NPY5RKDM4EINSRITKALDH1A1
SCHEMBL20183494 0.69 ALDH1A1 (0.39) NPY5RKDM4EPOLBITKALDH1A1
SCHEMBL20183843 0.69 RORC (0.44) NPY5RKDM4EINSRITKALDH1A1
SCHEMBL21549481 0.68 RORC (0.39) NPY5RTHRBKDM4EPOLBL3MBTL1
SCHEMBL5984776 0.68 KDM4E (0.64) THRBKDM4EPOLBL3MBTL1HSD17B10

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 13 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
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 CNR1 327/4885CNR2 675/4885NPY5R 1685/4885
US-10696637-B2 Nitrogen-containing heterocyclic compound CXCL10, CCL5, CXCR3 CNR1 534/4885CNR2 918/4885NPY5R 1196/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 CNR1 327/4885CNR2 675/4885NPY5R 1685/4885
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND CXCL10, CCL5, CXCR3 CNR1 534/4885CNR2 918/4885NPY5R 1196/4885
US-10633343-B2 CXCL10, CCL5, CXCR3 CNR1 1562/4885CNR2 2208/4885NPY5R 991/4885

“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.