SCHEMBL4049573

SCHEMBL4049573

CCOc1cc(C(=O)NC2CCN(C)CC2)ccc1N

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.51
SSTR5 P35346 5/20 0.51
ALDH1A1 P00352 2/20 0.50
HPGD P15428 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TP53 P04637 1/20 0.50
ALK Q9UM73 3/20 0.49
LMNA P02545 1/20 0.48
GLA P06280 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CTDSP1 Q9GZU7 1/20 0.48
SLC6A5 Q9Y345 1/20 0.48
BRD4 O60885 1/20 0.48
PLK1 P53350 1/20 0.48
IGF1R P08069 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL3933554 0.93 SSTR5 (0.47) SSTR4SSTR5ALDH1A1HPGDRAB9A
SCHEMBL3537704 0.93 SSTR5 (0.47) SSTR4SSTR5ALDH1A1HPGDRAB9A
SCHEMBL17034326 0.90 HTR4 (0.51) SLC6A5BRD4
SCHEMBL13575476 0.90 SSTR5 (0.55) SSTR5ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL28079636 0.89 HPGD (0.62) SSTR5ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL13175554 0.88 HRH3 (0.55) SSTR5ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL738237 0.87 HTR4 (0.53) BRD4
SCHEMBL9996770 0.86 SSTR4 (0.51) SSTR4ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL13575620 0.85 HPGD (0.51) SSTR5ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL13575616 0.85 BRD4 (0.53) SSTR5ALDH1A1HPGDRAB9ASMN1; 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-RE50082-E1 (5,6-dihydro)pyrimido[4,5-e]indolizines NETHERLANDS TRANSLATIONAL RESEARCH CENTER B.V. (NL) 2024-08-20 US disclosed
EP-3129374-B1 (5,6-DIHYDRO)PYRIMIDO[4,5-E]INDOLIZINES NETHERLANDS TRANSLATIONAL RES CENTER B V (NL) 2018-12-19 EP disclosed
US-9856258-B2 (5,6-dihydro)pyrimido[4,5-E]indolizines NETHERLANDS TRANSLATIONAL RESEARCH CENTER B.V. (NL) 2018-01-02 US disclosed
US-20170096432-A1 (5,6-DIHYDRO)PYRIMIDO[4,5-E]INDOLIZINES NETHERLANDS TRANSLATIONAL RESEARCH CENTER B.V. (NL) 2017-04-06 US disclosed
EP-3129374-A1 (5,6-DIHYDRO)PYRIMIDO[4,5-E]INDOLIZINES Netherlands Translational Research Center B.V. (NL) 2017-02-15 EP disclosed
WO-2015155042-A1 (5,6-DIHYDRO)PYRIMIDO[4,5-E]INDOLIZINES NETHERLANDS TRANSLATIONAL RESEARCH CENTER B.V. (NL) 2015-10-15 WO disclosed
EP-2564850-A1 Polo-like kinase inhibitors Takeda Pharmaceutical Company Limited (JP) 2013-03-06 EP disclosed
WO-2011036566-A1 METHODS FOR PREPARING PYRIMIDINE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-03-31 WO disclosed
EP-1983987-B1 DIHYDRODIAZEPINES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMA (US) 2010-09-01 EP disclosed
WO-2009153197-A1 HALO-SUBSTITUTED PYRIMIDODIAZEPINES AS PLKL INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2009-12-23 WO disclosed
US-20090312336-A1 DIHYDROPTERIDINE COMPOUNDS AS ANTI PROLIFERATIVE AGENTS ASTRAZENECA AB (SE) 2009-12-17 US disclosed
US-20090312336-A1 DIHYDROPTERIDINE COMPOUNDS AS ANTI PROLIFERATIVE AGENTS ASTRAZENECA AB (SE) 2009-12-17 US disclosed
US-20090312336-A1 DIHYDROPTERIDINE COMPOUNDS AS ANTI PROLIFERATIVE AGENTS ASTRAZENECA AB (SE) 2009-12-17 US disclosed
WO-2009112524-A1 PYRIDOPYRIMIDINES AS PLK1 ( POLO-LIKE KINASE) INHIBITORS 4SC AG (DE) 2009-09-17 WO disclosed
EP-2100894-A1 Pyridopyrimidines used as Plk1 (polo-like kinase) inhibitors 4SC AG (DE) 2009-09-16 EP disclosed
WO-2009042711-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-04-02 WO disclosed
WO-2007135374-A1 DIHYDROPTERIDINE COMPOUNDS AS ANTI PROLIFERATIVE AGENTS ASTRAZENECA AB (SE) 2007-11-29 WO disclosed
WO-2007095188-A2 DIHYDRODIAZEPINES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-08-23 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 (2 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-20170096432-A1 (5,6-DIHYDRO)PYRIMIDO[4,5-E]INDOLIZINES DHFR, CYP2D6, DPYD SSTR4 1266/4885SSTR5 358/4885ALDH1A1 111/4885
US-20090312336-A1 DIHYDROPTERIDINE COMPOUNDS AS ANTI PROLIFERATIVE AGENTS QDPR, PLK2, PFKP SSTR4 520/4885SSTR5 717/4885ALDH1A1 921/4885

“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.