SCHEMBL20183564

SCHEMBL20183564

CCNc1ccc(C(=O)N(C)c2ccc3c(c2)c(C2CC2)cc(=O)n3CC)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
NPY5R Q15761 2/20 0.34
RAB9A P51151 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 3/20 0.33
MAPT P10636 3/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
GLA P06280 1/20 0.33
CD38 P28907 1/20 0.33
RORC P51449 1/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 1/20 0.33
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32
TP53 P04637 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
SCHEMBL20183805 0.90 ALDH1A1 (0.37) ALDH1A1NPY5RRAB9AKDM4EMAPT
SCHEMBL20183767 0.90 HTT (0.43) ALDH1A1NPY5RNPSR1MAPTLMNA
SCHEMBL20183680 0.89 MCHR1 (0.39) ALDH1A1NPY5RRAB9AKDM4EHTT
SCHEMBL20183518 0.89 BRD4 (0.39) ALDH1A1NPY5RRAB9AKDM4EMAPT
SCHEMBL20183795 0.89 KDM4E (0.38) ALDH1A1NPY5RNPSR1KDM4EMAPT
SCHEMBL20183858 0.89 NPY5R (0.39) ALDH1A1NPY5RKDM4EMAPTGLA
SCHEMBL20183496 0.88 ALDH1A1 (0.36) ALDH1A1NPY5RRAB9AKDM4EMAPT
SCHEMBL20183710 0.88 SMN1; SMN2 (0.37) ALDH1A1NPY5RRAB9ANPSR1KDM4E
SCHEMBL20183620 0.88 ITK (0.38) ALDH1A1NPY5RKDM4EMAPTHTT
SCHEMBL20183493 0.88 MAPT (0.37) ALDH1A1NPY5RRAB9ANPSR1KDM4E

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
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-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
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
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 ALDH1A1 3243/4885NPY5R 1685/4885RAB9A 3282/4885
US-10696637-B2 Nitrogen-containing heterocyclic compound CXCL10, CCL5, CXCR3 ALDH1A1 3095/4885NPY5R 1196/4885RAB9A 2891/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 ALDH1A1 3243/4885NPY5R 1685/4885RAB9A 3282/4885
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND CXCL10, CCL5, CXCR3 ALDH1A1 3095/4885NPY5R 1196/4885RAB9A 2891/4885
US-10633343-B2 CXCL10, CCL5, CXCR3 ALDH1A1 2674/4885NPY5R 991/4885RAB9A 3106/4885

“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.