SCHEMBL7369403

SCHEMBL7369403

COC(=O)c1cc(-c2nn(C(C)C)c(=O)c3cccnc23)ccc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.44
POLB P06746 2/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KAT2B Q92831 1/20 0.40
MAPT P10636 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PSMD14 O00487 1/20 0.38
MAP2K1 Q02750 1/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 3/20 0.36
ALDH1A1 P00352 2/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
ADORA1 P30542 1/20 0.36
IL1B P01584 1/20 0.36
METAP2 P50579 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
USP2 O75604 1/20 0.36
MAPK1 P28482 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
SCHEMBL7369732 0.92 KDM4E (0.44) KDM4EPOLBTSHRHSD17B10KAT2B
SCHEMBL7363887 0.84 KAT2B (0.52) KDM4EPOLBTSHRHSD17B10KAT2B
SCHEMBL7365735 0.84 PDE4A (0.44) KDM4ETSHRGAAMETAP2SMN1; SMN2
SCHEMBL7371143 0.84 KDM4E (0.53) KDM4EPOLBTSHRHSD17B10KAT2B
SCHEMBL7363855 0.83 PDE4A (0.47) KDM4EPOLBHSD17B10MAPTL3MBTL1
SCHEMBL7370274 0.81 PDE4A (0.52) KDM4EMAPTL3MBTL1ALDH1A1GAA
SCHEMBL7365395 0.80 PDE4A (0.61) KDM4EPOLBLMNAALDH1A1GAA
SCHEMBL7370561 0.78 L3MBTL1 (0.47) POLBKAT2BMAPTL3MBTL1ALDH1A1
SCHEMBL7363886 0.78 KDM4E (0.44) KDM4EPOLBTSHRL3MBTL1HPGD
SCHEMBL7363024 0.78 KMT2A (0.50) KDM4EMAPTL3MBTL1PSMD14LMNA

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
EP-0612321-A1 PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1994-08-31 EP disclosed
WO-1993007146-A1 BENZO AND PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1993-04-15 WO disclosed