SCHEMBL6981091

SCHEMBL6981091

CCCCn1c(N)c(C#N)c2nc3ccccc3nc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRK6 P43250 1/20 1.00
KDM4E B2RXH2 15/20 0.93
GAA P10253 14/20 0.93
ALDH1A1 P00352 14/20 0.93
HPGD P15428 14/20 0.93
GLA P06280 11/20 0.93
CASP1 P29466 10/20 0.93
HSD17B10 Q99714 10/20 0.93
CASP7 P55210 9/20 0.93
MAPT P10636 5/20 0.93
SAE1 Q9UBE0 4/20 0.93
UBA2 Q9UBT2 4/20 0.93
POLB P06746 4/20 0.93
KMT2A Q03164 6/20 0.76
MEN1 O00255 4/20 0.76
LMNA P02545 3/20 0.72
MAPK1 P28482 2/20 0.70
ALOX15 P16050 5/20 0.65
TSHR P16473 2/20 0.64
FPR1 P21462 2/20 0.64

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
SCHEMBL30656632 1.00 GRK6 (1.00) GRK6KDM4EGAAALDH1A1HPGD
SCHEMBL6980640 0.82 GRK6 (0.70) GRK6KDM4EGAAALDH1A1HPGD
SCHEMBL15256907 0.78 SAE1 (1.00) GRK6KDM4EGAAALDH1A1HPGD
SCHEMBL7691778 0.76 GRK6 (0.61) GRK6KDM4EGAAALDH1A1HPGD
SCHEMBL7691280 0.76 GRK6 (0.61) GRK6KDM4EGAAALDH1A1HPGD
SCHEMBL4787869 0.76 SAE1 (1.00) GRK6KDM4EGAAALDH1A1HPGD
SCHEMBL15256873 0.73 SAE1 (0.87) GRK6KDM4EGAAALDH1A1HPGD
SCHEMBL15032608 0.73 ALDH1A1 (0.71) GRK6KDM4EGAAALDH1A1HPGD
SCHEMBL15256916 0.73 KDM4E (0.62) GRK6KDM4EGAAALDH1A1HPGD
SCHEMBL15256914 0.73 SAE1 (1.00) GRK6KDM4EGAAALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250354117-A1 METHODS OF GENERATING NATURAL KILLER CELLS FROM PLURIPOTENT STEM CELLS AND COMPOSITIONS THEREOF CHILDRENS MEDICAL CT CORP (US) 2025-11-20 US disclosed
US-10252984-B2 Inhibiting G protein coupled receptor 6 kinase polypeptides MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2019-04-09 US disclosed
US-9045483-B2 Inhibition of small ubiquitin-like modifier enzymes with substituted pyrrolo[2,3-b]quinoxalines CITY OF HOPE (US) 2015-06-02 US disclosed
US-9045483-B2 Inhibition of small ubiquitin-like modifier enzymes with substituted pyrrolo[2,3-b]quinoxalines CITY OF HOPE (US) 2015-06-02 US disclosed
US-20140309185-A1 Inhibiting G Protein Coupled Receptor 6 Kinase Polypeptides MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2014-10-16 US disclosed
US-20130245032-A1 BICYCLIC AND TRICYCLIC INHIBITORS OF SUMOYLATION ENZYMES AND METHODS OF THEIR USE Sanford-Burnham Medical Research Institute at Lake Nona (US) 2013-09-19 US disclosed
US-20130245032-A1 BICYCLIC AND TRICYCLIC INHIBITORS OF SUMOYLATION ENZYMES AND METHODS OF THEIR USE Sanford-Burnham Medical Research Institute at Lake Nona (US) 2013-09-19 US disclosed
WO-2013063458-A2 INHIBITING G PROTEIN COUPLED RECEPTOR 6 KINASE POLYPEPTIDES MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2013-05-02 WO disclosed
WO-2012064897-A2 BICYCLIC AND TRICYCLIC INHIBITORS OF SUMOYLATION ENZYMES AND METHODS FOR THEIR USE CHEN YUAN (US) 2012-05-18 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-20130245032-A1 BICYCLIC AND TRICYCLIC INHIBITORS OF SUMOYLATION ENZYMES AND METHODS OF THEIR USE SUMO1, SUMO2, SAE1 GRK6 4107/4885KDM4E 386/4885GAA 1531/4885
US-20140309185-A1 Inhibiting G Protein Coupled Receptor 6 Kinase Polypeptides GRK6, GRK2, GRK3 GRK6 1/4885KDM4E 4504/4885GAA 2160/4885
US-10252984-B2 Inhibiting G protein coupled receptor 6 kinase polypeptides GRK6, GRK2, GRK3 GRK6 1/4885KDM4E 4504/4885GAA 2160/4885

“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.