SCHEMBL1576836

SCHEMBL1576836

CCOCc1nc(-c2ccc(OCC(O)CN(C)C)cc2)cn1-c1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGER Q15109 7/20 0.58
CDK4 P11802 7/20 0.44
CDK2 P24941 6/20 0.44
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
HIF1A Q16665 2/20 0.38
HTT P42858 1/20 0.38
DAPK3 O43293 1/20 0.38
JAK2 O60674 1/20 0.38
PRKD3 O94806 1/20 0.38
MAP4K4 O95819 1/20 0.38
PAK4 O96013 1/20 0.38
ABL1 P00519 1/20 0.38
LCK P06239 1/20 0.38
FYN P06241 1/20 0.38
CSF1R P07333 1/20 0.38
IGF1R P08069 1/20 0.38
PDGFRB P09619 1/20 0.38
FGFR1 P11362 1/20 0.38
PDGFRA P16234 1/20 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
SCHEMBL1577211 1.00 AGER (0.58) AGERCDK4CDK2ALDH1A1HPGD
SCHEMBL1576894 1.00 AGER (0.58) AGERCDK4CDK2ALDH1A1HPGD
Hydrochloric Acid SCHEMBL1895163 0.99 AGER (0.57) AGERCDK4CDK2ALDH1A1HPGD
Hydrochloric Acid SCHEMBL1576891 0.99 AGER (0.57) AGERCDK4CDK2ALDH1A1HPGD
Hydrochloric Acid SCHEMBL1886702 0.99 AGER (0.57) AGERCDK4CDK2ALDH1A1HPGD
SCHEMBL1576872 0.93 AGER (0.59) AGERCDK4CDK2LMNASMN1; SMN2
SCHEMBL1577183 0.93 AGER (0.59) AGERCDK4CDK2LMNASMN1; SMN2
SCHEMBL1577184 0.93 AGER (0.59) AGERCDK4CDK2LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL1890959 0.92 AGER (0.59) AGERCDK4CDK2LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL1576941 0.92 AGER (0.59) AGERCDK4CDK2LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170157093-A1 Substituted Imidazole Derivatives and Methods of Use Thereof VTV THERAPEUTICS LLC 2017-06-08 US claimed
US-9598375-B2 Substituted imidazole derivatives and methods of use thereof VTV THERAPEUTICS LLC (US) 2017-03-21 US claimed
EP-2470510-B1 SUBSTITUTED IMIDAZOLE DERIVATIVES FOR TREATMENT OF ALZHEIMERS DISEASE. TRANSTECH PHARMA LLC (US) 2014-05-14 EP claimed
US-20140039025-A1 Substituted Imidazole Derivatives and Methods of Use Thereof TRANSTECH PHARMA, INC. (US) 2014-02-06 US claimed
US-8580833-B2 Substituted imidazole derivatives and methods of use thereof TRANSTECH PHARMA, INC. (US) 2013-11-12 US claimed
EP-2470510-A1 SUBSTITUTED IMIDAZOLE DERIVATIVES FOR TREATMENT OF ALZHEIMERS DISEASE TransTech Pharma, Inc. (US) 2012-07-04 EP claimed
US-20110105578-A1 Substituted Imidazole Derivatives And Methods Of Use Thereof VTV THERAPEUTICS LLC 2011-05-05 US claimed
WO-2011041198-A1 SUBSTITUTED IMIDAZOLE DERIVATIVES FOR TREATMENT OF ALZHEIMERS DISEASE TRANSTECH PHARMA, INC. (US) 2011-04-07 WO claimed
US-10363241-B2 Substituted imidazole derivatives and methods of use thereof VTV THERAPEUTICS LLC (US) 2019-07-30 US disclosed
US-20190076402-A1 Substituted Imidazole Derivatives and Methods of Use Thereof TRANSTECH PHARMA, INC. 2019-03-14 US disclosed
US-20170157093-A1 Substituted Imidazole Derivatives and Methods of Use Thereof VTV THERAPEUTICS LLC 2017-06-08 US disclosed
US-9598375-B2 Substituted imidazole derivatives and methods of use thereof VTV THERAPEUTICS LLC (US) 2017-03-21 US disclosed
EP-2470510-B1 SUBSTITUTED IMIDAZOLE DERIVATIVES FOR TREATMENT OF ALZHEIMERS DISEASE. TRANSTECH PHARMA LLC (US) 2014-05-14 EP disclosed
US-20140039025-A1 Substituted Imidazole Derivatives and Methods of Use Thereof TRANSTECH PHARMA, INC. (US) 2014-02-06 US disclosed
US-8580833-B2 Substituted imidazole derivatives and methods of use thereof TRANSTECH PHARMA, INC. (US) 2013-11-12 US disclosed
EP-2470510-A1 SUBSTITUTED IMIDAZOLE DERIVATIVES FOR TREATMENT OF ALZHEIMERS DISEASE TransTech Pharma, Inc. (US) 2012-07-04 EP disclosed
US-20110105578-A1 Substituted Imidazole Derivatives And Methods Of Use Thereof VTV THERAPEUTICS LLC 2011-05-05 US disclosed
WO-2011041198-A1 SUBSTITUTED IMIDAZOLE DERIVATIVES FOR TREATMENT OF ALZHEIMERS DISEASE TRANSTECH PHARMA, INC. (US) 2011-04-07 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 (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-20170157093-A1 Substituted Imidazole Derivatives and Methods of Use Thereof CYP11B2, CYP2C19, SLC10A2 AGER 1632/4885CDK4 2619/4885CDK2 2378/4885
US-20140039025-A1 Substituted Imidazole Derivatives and Methods of Use Thereof MAPT, PSEN2, PSEN1 AGER 371/4885CDK4 2745/4885CDK2 2459/4885
US-20190076402-A1 Substituted Imidazole Derivatives and Methods of Use Thereof CYP3A7, CYP3A5, CYP3A43 AGER 3594/4885CDK4 1658/4885CDK2 1035/4885
US-10363241-B2 Substituted imidazole derivatives and methods of use thereof CYP3A7, CYP3A5, CYP3A43 AGER 3594/4885CDK4 1658/4885CDK2 1035/4885
US-20110105578-A1 Substituted Imidazole Derivatives And Methods Of Use Thereof AGER, NOD2, PSEN1 AGER 1/4885CDK4 3078/4885CDK2 2782/4885

“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.