SCHEMBL3995482

SCHEMBL3995482

CCOC(=O)C1CCN(c2cccc(-c3cc(F)cc(F)c3OCc3ccc(Br)cc3C)n2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPK1 P28482 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 4/20 0.42
KDM4E B2RXH2 3/20 0.42
HPGD P15428 2/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.40
TP53 P04637 1/20 0.39
RAB9A P51151 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPC1 O15118 1/20 0.39
CCR5 P51681 1/20 0.38
GUCY1B2 O75343 4/20 0.38
GUCY1A2 P33402 4/20 0.38
GUCY1A1 Q02108 4/20 0.38

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
SCHEMBL17609412 0.92 ALDH1A1 (0.41) ALDH1A1TDP1MAPK1MEN1KMT2A
SCHEMBL3234892 0.87 GUCY1B2 (0.44) ALDH1A1TDP1MAPK1MEN1KMT2A
SCHEMBL17609399 0.87 GUCY1A1 (0.47) ALDH1A1TDP1HPGDTSHRHSD17B10
SCHEMBL17609408 0.87 GUCY1B2 (0.46) ALDH1A1MAPK1MEN1KMT2AMAPT
SCHEMBL17609430 0.86 GUCY1A1 (0.40) ALDH1A1TDP1GUCY1B2GUCY1A2GUCY1A1
SCHEMBL17609481 0.85 GUCY1A1 (0.39) ALDH1A1TDP1MEN1KMT2AKDM4E
SCHEMBL17609380 0.85 ALDH1A1 (0.41) ALDH1A1TDP1KDM4EHPGDTSHR
SCHEMBL17614616 0.85 GUCY1A1 (0.42) ALDH1A1TDP1KDM4EHPGDTSHR
SCHEMBL19498872 0.85 GUCY1A1 (0.40) ALDH1A1TDP1HPGDTSHRHSD17B10
SCHEMBL17609383 0.85 GUCY1B2 (0.45) GUCY1B2GUCY1A2GUCY1A1GUCY1B1

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-10472350-B2 Soluble guanylate cyclase activators and their use GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-12 US disclosed
US-10472350-B2 Soluble guanylate cyclase activators and their use GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-12 US disclosed
US-20180194756-A1 NOVEL SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND THEIR USE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-07-12 US disclosed
US-20180194756-A1 NOVEL SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND THEIR USE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-07-12 US disclosed
US-20180194756-A1 NOVEL SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND THEIR USE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-07-12 US disclosed
US-9938260-B2 Soluble guanylate cyclase activators and their use GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-04-10 US disclosed
US-9938260-B2 Soluble guanylate cyclase activators and their use GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-04-10 US disclosed
US-9938260-B2 Soluble guanylate cyclase activators and their use GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-04-10 US disclosed
US-20170305888-A1 NOVEL SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND THEIR USE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-10-26 US disclosed
US-20170305888-A1 NOVEL SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND THEIR USE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-10-26 US disclosed
US-20170305888-A1 NOVEL SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND THEIR USE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-10-26 US disclosed
EP-3194384-A1 NOVEL SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND THEIR USE GlaxoSmithKline Intellectual Property Development Limited (GB) 2017-07-26 EP disclosed
WO-2016042536-A1 NOVEL SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND THEIR USE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2016-03-24 WO disclosed
WO-2016042536-A1 NOVEL SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND THEIR USE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2016-03-24 WO disclosed
WO-2009071504-A1 2,6-DISUBSTITUTED PYRIDINES AS SOLUBLE GUANYLATE CYCLASE ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2009-06-11 WO 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 (3 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-20170305888-A1 NOVEL SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND THEIR USE GUCY1A2, GUCY1A1, GUCY1B1 ALDH1A1 2631/4885TDP1 343/4885MAPK1 1567/4885
US-10472350-B2 Soluble guanylate cyclase activators and their use GUCY1A2, GUCY1A1, GUCY1B2 ALDH1A1 2139/4885TDP1 384/4885MAPK1 1378/4885
US-20180194756-A1 NOVEL SOLUBLE GUANYLATE CYCLASE ACTIVATORS AND THEIR USE GUCY1A2, GUCY1A1, GUCY1B1 ALDH1A1 2631/4885TDP1 343/4885MAPK1 1567/4885

“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.