SCHEMBL2364796

SCHEMBL2364796

CCCCC(=O)NN1CCCCC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.58
GNAO1 P09471 1/20 0.58
GNAI1 P63096 1/20 0.58
ALDH1A1 P00352 5/20 0.50
MAPT P10636 2/20 0.50
CNR2 P34972 2/20 0.50
CNR1 P21554 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 2/20 0.45
KDM4E B2RXH2 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
NPSR1 Q6W5P4 2/20 0.41
ATM Q13315 1/20 0.41
HTT P42858 1/20 0.41
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL16405435 0.98 GNAI3 (0.60) GNAI3GNAO1GNAI1ALDH1A1MAPT
SCHEMBL16010753 0.93 GNAI3 (0.69) GNAI3GNAO1GNAI1ALDH1A1MAPT
SCHEMBL3868277 0.93 GNAI3 (0.69) GNAI3GNAO1GNAI1ALDH1A1MAPT
SCHEMBL3974367 0.93 GNAI3 (0.69) GNAI3GNAO1GNAI1ALDH1A1MAPT
SCHEMBL3871463 0.91 GNAI3 (0.71) GNAI3GNAO1GNAI1CNR2CNR1
SCHEMBL11215579 0.91 GNAI3 (0.71) GNAI3GNAO1GNAI1CNR2CNR1
SCHEMBL8588178 0.91 GNAI3 (0.71) GNAI3GNAO1GNAI1CNR2CNR1
SCHEMBL493880 0.88 TP53 (0.50) GNAI3GNAO1GNAI1ALDH1A1MAPT
SCHEMBL2364252 0.88 TP53 (0.50) GNAI3GNAO1GNAI1ALDH1A1MAPT
SCHEMBL3879759 0.86 GNAI3 (0.50) GNAI3GNAO1GNAI1ALDH1A1CNR2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE49594-E1 Apelin receptor (APJ) agonists and uses thereof RESEARCH TRIANGLE INSTITUTE (US) 2023-08-01 US disclosed
US-11535630-B2 Apelin receptor (APJ) agonists and uses thereof RESEARCH TRIANGLE INSTITUTE (US) 2022-12-27 US disclosed
US-10954247-B2 Apelin receptor (APJ) agonists and uses thereof RESEARCH TRIANGLE INSTITUTE (NC) 2021-03-23 US disclosed
US-20210070767-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF RESEARCH TRIANGLE INSTITUTE 2021-03-11 US disclosed
EP-3386976-A1 IMPROVED APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF Research Triangle Institute, International (US) 2018-10-17 EP disclosed
US-10100059-B2 Apelin receptor (APJ) agonists and uses thereof RESEARCH TRIANGLE INSTITUTE (US) 2018-10-16 US disclosed
US-20180265518-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF RESEARCH TRIANGLE INSTITUTE 2018-09-20 US disclosed
WO-2017100558-A1 IMPROVED APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF RESEARCH TRIANGLE INSTITUTE (US) 2017-06-15 WO disclosed
US-20170166577-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF RESEARCH TRIANGLE INSTITUTE 2017-06-15 US disclosed
EP-2125782-B1 ARYL CARBOXYLIC ACID CYCLOHEXYL AMIDE DERIVATIVES NOVARTIS AG (CH) 2011-08-03 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 (6 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-20170166577-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF APLNR, AP1G1, APMAP GNAI3 630/4885GNAO1 690/4885GNAI1 915/4885
US-10100059-B2 Apelin receptor (APJ) agonists and uses thereof APLNR, AP1G1, APMAP GNAI3 630/4885GNAO1 690/4885GNAI1 915/4885
US-11535630-B2 Apelin receptor (APJ) agonists and uses thereof APLNR, AP1G1, APMAP GNAI3 630/4885GNAO1 690/4885GNAI1 915/4885
US-20210070767-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF APLNR, AP1G1, APMAP GNAI3 630/4885GNAO1 690/4885GNAI1 915/4885
US-20180265518-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF APLNR, AP1G1, APMAP GNAI3 630/4885GNAO1 690/4885GNAI1 915/4885
US-10954247-B2 Apelin receptor (APJ) agonists and uses thereof APLNR, AP1G1, APMAP GNAI3 630/4885GNAO1 690/4885GNAI1 915/4885

“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.