SCHEMBL20183710

SCHEMBL20183710

CCc1ccc(C(=O)N(C)c2ccc3c(c2)c(C2CC2)cc(=O)n3CC)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.37
NPY5R Q15761 1/20 0.37
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 4/20 0.36
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
GLA P06280 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RORC P51449 1/20 0.34
RAB9A P51151 1/20 0.33
HIF1A Q16665 1/20 0.33
EPAS1 Q99814 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 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
SCHEMBL20183858 0.92 NPY5R (0.39) SMN1; SMN2NPY5RKDM4EALDH1A1GLA
SCHEMBL20183805 0.92 ALDH1A1 (0.37) SMN1; SMN2NPY5RKDM4EALDH1A1HTR3E
SCHEMBL20183518 0.91 BRD4 (0.39) SMN1; SMN2NPY5RKDM4EALDH1A1GLA
SCHEMBL20183680 0.91 MCHR1 (0.39) NPY5RKDM4EALDH1A1HTR3EHTR3B
SCHEMBL20183493 0.90 MAPT (0.37) SMN1; SMN2NPY5RKDM4EALDH1A1HPGD
SCHEMBL20183496 0.90 ALDH1A1 (0.36) NPY5RKDM4EALDH1A1HTR3EHTR3B
SCHEMBL20183620 0.90 ITK (0.38) NPY5RKDM4EALDH1A1TSHRRORC
SCHEMBL20183851 0.90 ALDH1A1 (0.41) SMN1; SMN2NPY5RKDM4EALDH1A1HTR3E
SCHEMBL20183794 0.90 NPY5R (0.38) NPY5RKDM4EALDH1A1GLARORC
SCHEMBL20354283 0.89 KDM4E (0.38) SMN1; SMN2KDM4EALDH1A1HTR3EHTR3B

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 12 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
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-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 SMN1; SMN2 4557/4885NPY5R 1685/4885KDM4E 1027/4885
US-10696637-B2 Nitrogen-containing heterocyclic compound CXCL10, CCL5, CXCR3 SMN1; SMN2 3085/4885NPY5R 1196/4885KDM4E 3906/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 SMN1; SMN2 4557/4885NPY5R 1685/4885KDM4E 1027/4885
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND CXCL10, CCL5, CXCR3 SMN1; SMN2 3085/4885NPY5R 1196/4885KDM4E 3906/4885
US-10633343-B2 CXCL10, CCL5, CXCR3 SMN1; SMN2 3653/4885NPY5R 991/4885KDM4E 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.