SCHEMBL20183798

SCHEMBL20183798

CCn1c(=O)cc(C2CCN(CC#N)CC2)c2cc(N(C)C(=O)c3cccc(Cl)c3)ccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 3/20 0.36
RORC P51449 1/20 0.35
THRB P10828 1/20 0.35
KDM2B Q8NHM5 1/20 0.35
KCNH2 Q12809 3/20 0.34
TP53 P04637 2/20 0.34
GAA P10253 1/20 0.34
POLB P06746 1/20 0.34
LMNA P02545 2/20 0.33
USP2 O75604 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PLK1 P53350 1/20 0.33
GLA P06280 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
TACR2 P21452 1/20 0.32
TACR1 P25103 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
SCHEMBL20183603 0.91 RORC (0.39) ALDH1A1RORCPOLBLMNAMAPT
SCHEMBL20183549 0.87 MEN1 (0.36) MEN1KMT2AALDH1A1THRBKDM2B
SCHEMBL20183664 0.86 SLC6A2 (0.40) MEN1KMT2AALDH1A1RORCTHRB
SCHEMBL20183554 0.80 LMNA (0.38) MEN1KMT2AALDH1A1RORCKDM2B
SCHEMBL20183819 0.80 HSD17B1 (0.38) MEN1KMT2AALDH1A1RORC
SCHEMBL20183748 0.80 ELANE (0.39) ALDH1A1THRBTP53LMNAMAPT
SCHEMBL20183851 0.80 ALDH1A1 (0.41) ALDH1A1RORCMAPTHTTSMN1; SMN2
SCHEMBL20183558 0.80 HSD17B2 (0.45) MEN1KMT2AALDH1A1TP53GAA
SCHEMBL20183633 0.80 ALDH1A1 (0.36) MEN1KMT2AALDH1A1RORCHSD17B10
SCHEMBL23256500 0.79 KDM4E (0.42) MEN1KMT2AALDH1A1RORCPOLB

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 MEN1 1349/4885KMT2A 359/4885ALDH1A1 3243/4885
US-10696637-B2 Nitrogen-containing heterocyclic compound CXCL10, CCL5, CXCR3 MEN1 524/4885KMT2A 3299/4885ALDH1A1 3095/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 MEN1 1349/4885KMT2A 359/4885ALDH1A1 3243/4885
US-20190077761-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND CXCL10, CCL5, CXCR3 MEN1 524/4885KMT2A 3299/4885ALDH1A1 3095/4885
US-10633343-B2 CXCL10, CCL5, CXCR3 MEN1 953/4885KMT2A 3171/4885ALDH1A1 2674/4885

“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.