SCHEMBL7866466

SCHEMBL7866466

CC(C)CNc1cccnc1N1CCN(C(=O)c2ccc(C(=O)NC(C)C)cn2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTK P33981 1/20 0.42
PRMT5 O14744 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
PRKAB2 O43741 2/20 0.40
PRKAG1 P54619 2/20 0.40
PRKAA2 P54646 2/20 0.40
PRKAA1 Q13131 2/20 0.40
PRKAG3 Q9UGI9 2/20 0.40
PRKAG2 Q9UGJ0 2/20 0.40
PRKAB1 Q9Y478 2/20 0.40
ADRA2A P08913 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
CHRM1 P11229 1/20 0.39
MAOA P21397 1/20 0.39

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
SCHEMBL7869768 0.92 PARP1 (0.46) PRMT5MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL7873078 0.91 PLA2G1B (0.45) PRMT5MEN1KMT2AALDH1A1PRKAB2
SCHEMBL7861548 0.91 HCAR3 (0.46) PRMT5MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL7872872 0.89 SCD (0.42) PRMT5MEN1KMT2ALMNAPRKAB2
SCHEMBL7861522 0.89 ADRA2A (0.49) PRMT5MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL8494125 0.88 SCD (0.43) TTKPRMT5MEN1KMT2APRKAB2
SCHEMBL7869029 0.87 SCD (0.41) PRMT5MEN1KMT2AALDH1A1HPGD
SCHEMBL7868092 0.87 DGAT2 (0.38) PRMT5MEN1KMT2AALDH1A1PRKAB2
SCHEMBL8495212 0.87 NR0B1 (0.40) PRMT5ALDH1A1LMNAMAPTPRKAB2
SCHEMBL7869108 0.86 PRMT5 (0.46) PRMT5MEN1KMT2APRKAB2PRKAG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6306860-B1 ANTIVIRAL ACTIVITIES AGAINST HEPATATIS B AS WELL AS HUMAN IMMUNODEFICIENCY VIRUS DONG WHA PHARM. INC. CO., LTD. (KR) 2001-10-23 US disclosed
WO-1999058526-A1 NOVEL 2,5-PYRIDINEDICARBOXYLIC ACID DERIVATIVES DONG WHA PHARM. IND. CO., LTD. (KR) 1999-11-18 WO disclosed