SCHEMBL8312062

SCHEMBL8312062

Cc1c(C#N)sc2nc(-c3ccc(Cl)cc3)nc(N3CCC(C)(N)CC3)c12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.61
HPGD P15428 5/20 0.61
ALDH1A1 P00352 4/20 0.61
HSD17B10 Q99714 3/20 0.61
TSHR P16473 1/20 0.61
PRKCI P41743 2/20 0.40
MAPT P10636 3/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PTPN11 Q06124 7/20 0.39
NPSR1 Q6W5P4 2/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RXFP1 Q9HBX9 2/20 0.36
KIT P10721 3/20 0.36
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35

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
SCHEMBL8311286 0.92 ALDH1A1 (0.64) KDM4EHPGDALDH1A1HSD17B10TSHR
SCHEMBL8312543 0.90 KDM4E (0.77) KDM4EHPGDALDH1A1HSD17B10TSHR
SCHEMBL8306844 0.88 ALDH1A1 (0.59) KDM4EHPGDALDH1A1HSD17B10TSHR
SCHEMBL8311877 0.87 KDM4E (0.58) KDM4EHPGDALDH1A1HSD17B10TSHR
SCHEMBL8306886 0.87 KDM4E (0.57) KDM4EHPGDALDH1A1HSD17B10TSHR
SCHEMBL2838108 0.85 KDM4E (0.66) KDM4EHPGDALDH1A1HSD17B10TSHR
SCHEMBL8306834 0.85 KDM4E (0.55) KDM4EHPGDALDH1A1HSD17B10TSHR
SCHEMBL2840661 0.85 KDM4E (0.65) KDM4EHPGDALDH1A1HSD17B10TSHR
SCHEMBL8313156 0.83 ALDH1A1 (0.53) KDM4EHPGDALDH1A1HSD17B10TSHR
SCHEMBL8313961 0.81 ALDH1A1 (0.52) KDM4EHPGDALDH1A1HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004065391-A1 4-AMINOTHIENO[2,3-d]PYRIMIDINE-6-CARBONITRILE DERIVATIVES AS PDE7 INHIBITORS ALMIRALL PRODESFARMA S.A. (ES) 2004-08-05 WO disclosed