SCHEMBL6980643

SCHEMBL6980643

O=c1ccn2c3ccccc3c3cccc1c32

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
POLB P06746 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
ALKBH5 Q6P6C2 1/20 0.39
FTO Q9C0B1 1/20 0.39
DUSP3 P51452 1/20 0.38
GPR3 P46089 1/20 0.35
HSP90AA1 P07900 1/20 0.35
IDO1 P14902 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2C19 P33261 2/20 0.34
CYP19A1 P11511 1/20 0.34
P2RX4 Q99571 1/20 0.34
PGR P06401 1/20 0.34
RORA P35398 1/20 0.34

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
SCHEMBL7662145 0.89 P2RX4 (0.43) KDM4EPOLBALDH1A1MAPTMEN1
SCHEMBL6979690 0.82 MEN1 (0.36) KDM4EPOLBALDH1A1MAPTMEN1
SCHEMBL6974173 0.81 MGLL (0.39) KDM4EMAPTMEN1KMT2AL3MBTL1
SCHEMBL6976283 0.81 CA1 (0.43) KDM4EALDH1A1HPGDCYP19A1RORC
SCHEMBL6975999 0.77 KDM4E (0.47) KDM4EALDH1A1MEN1HPGDKMT2A
SCHEMBL6979022 0.77 PGR (0.39) KDM4EPOLBALDH1A1MAPTMEN1
SCHEMBL13703591 0.77 ALKBH5 (0.39) KDM4EPOLBALDH1A1MAPTMEN1
SCHEMBL6976281 0.76 NPC1 (0.41) KDM4EALDH1A1MAPTMEN1HPGD
SCHEMBL4512211 0.76 ALKBH5 (0.41) KDM4EPOLBALDH1A1MAPTMEN1
SCHEMBL31190839 0.76 ALKBH5 (0.41) KDM4EPOLBALDH1A1MAPTMEN1

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
EP-0985671-B1 PYRIDOCARBAZOLE DERIVATIVES HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARM CO LTD (JP) 2003-04-02 EP disclosed