SCHEMBL6979869

SCHEMBL6979869

COc1ccc2c3ccccc3n3c2c1C(=O)CC3

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 4/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
PTPN1 P18031 1/20 0.41
MAPT P10636 4/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
DUSP3 P51452 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CYP1A1 P04798 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP1B1 Q16678 1/20 0.37
PIM1 P11309 3/20 0.37
PIM3 Q86V86 3/20 0.37
PIM2 Q9P1W9 1/20 0.37
SMARCA4 P51532 1/20 0.36

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
SCHEMBL6979132 0.77 KMT2A (0.43) ALDH1A1KDM4EHPGDPTPN1MAPT
SCHEMBL6981939 0.72 PIM1 (0.42) ALDH1A1KDM4EHPGDMAPTMEN1
SCHEMBL6982697 0.72 TUBB4A (0.42) ALDH1A1KDM4EHPGDMAPTMEN1
SCHEMBL3225974 0.71 KDM4E (0.46) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL6982969 0.69 KMT2A (0.46) ALDH1A1KDM4EGAAMAPTMEN1
SCHEMBL6983511 0.68 TUBB4A (0.42) ALDH1A1KDM4EHPGDMAPTNPSR1
SCHEMBL6983377 0.68 KMT2A (0.50) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL22140904 0.68 PTPN1 (0.53) ALDH1A1KDM4EGAAHPGDPTPN1
SCHEMBL9258757 0.68 TNFRSF1A (0.43) ALDH1A1KDM4EGLAHPGDPTPN1
SCHEMBL7670850 0.68 PTPN1 (0.41) PTPN1PIM1PIM3PIM2SMARCA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0985671-B1 PYRIDOCARBAZOLE DERIVATIVES HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARM CO LTD (JP) 2003-04-02 EP disclosed
US-6197768-B1 THERAPY, PREVENTION ISCHEMIC HEART DISEASE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2001-03-06 US disclosed
EP-0985671-A1 PYRIDOCARBAZOLE DERIVATIVES HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-03-15 EP disclosed
US-6018046-A SELECTIVE ACTION IN INHIBITING CYCLIC GMP-PHOSPHODIESTERASE (CGMP-PDE); PHARMACEUTICALS FOR TREATING DISEASES AGAINST WHICH THE INHIBITORY ACTION IS EFFECTIVE, SUCH AS PULMONARY HYPERTENSION MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-01-25 US disclosed