SCHEMBL1783780

SCHEMBL1783780

CC(C)C=NNC(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
CTSK P43235 11/20 0.49
MIF P14174 1/20 0.49
RAB9A P51151 4/20 0.47
NPC1 O15118 2/20 0.47
RECQL P46063 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
THRB P10828 1/20 0.47
KDM4E B2RXH2 2/20 0.43

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
SCHEMBL2671847 1.00 MAPT (0.50) MAPTCTSKMIFRAB9ANPC1
SCHEMBL5768258 0.84 CTSK (0.46) MAPTCTSKMIFRAB9ANPC1
SCHEMBL13302740 0.83 CTSK (0.40) MAPTCTSKMIFRAB9ANPC1
SCHEMBL5544738 0.79 CTSK (0.45) MAPTCTSKMIFRAB9ANPC1
SCHEMBL8829341 0.79 CTSK (0.45) MAPTCTSKMIFRAB9ANPC1
SCHEMBL8829337 0.79 CTSK (0.45) MAPTCTSKMIFRAB9ANPC1
SCHEMBL12731332 0.78 RAB9A (0.49) MAPTCTSKMIFRAB9ANPC1
SCHEMBL2943326 0.78 MIF (0.53) MAPTCTSKMIFRAB9ANPC1
SCHEMBL2943324 0.78 MIF (0.53) MAPTCTSKMIFRAB9ANPC1
SCHEMBL2683738 0.76 MIF (0.51) MAPTCTSKMIFRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11401244-B2 Apelin receptor (APJ) agonists and uses thereof RESEARCH TRIANGLE INSTITUTE (US) 2022-08-02 US disclosed
US-20190315693-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF RES TRIANGLE INST (US) 2019-10-17 US disclosed
US-10377718-B2 Apelin receptor (APJ) agonists and uses thereof RESEARCH TRIANGLE INSTITUTE (US) 2019-08-13 US disclosed
US-20160207889-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF RESEARCH TRIANGLE INSTITUTE 2016-07-21 US disclosed
US-8304556-B2 Thiazolyl-dihydro-indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-06 US disclosed
US-20120108567-A1 Thiazolyl-Dihydro-Indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-03 US disclosed
US-20110118208-A1 Thiazolyl-Dihydro-Indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-05-19 US disclosed
CN-102015728-A Thiazolyl-dihydro-indazoles BOEHRINGER INGELHEIM INT 2011-04-13 CN 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-20160207889-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF APLNR, AP1G1, APMAP MAPT 4339/4885CTSK 1229/4885MIF 3915/4885
US-11401244-B2 Apelin receptor (APJ) agonists and uses thereof APLNR, AP1G1, APMAP MAPT 4339/4885CTSK 1229/4885MIF 3915/4885
US-20120108567-A1 Thiazolyl-Dihydro-Indazoles MKI67, CYP11B1, IGF1R MAPT 2509/4885CTSK 3429/4885MIF 159/4885
US-20110118208-A1 Thiazolyl-Dihydro-Indazoles MKI67, CYP11B1, IGF1R MAPT 2509/4885CTSK 3429/4885MIF 159/4885
US-10377718-B2 Apelin receptor (APJ) agonists and uses thereof APLNR, AP1G1, APMAP MAPT 4339/4885CTSK 1229/4885MIF 3915/4885
US-20190315693-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF APLNR, AP1G1, APMAP MAPT 4339/4885CTSK 1229/4885MIF 3915/4885

“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.