SCHEMBL6984498

SCHEMBL6984498

Cc1cn2c3ccc(Br)cc3c3cc(OCCCCO)cc(c1=O)c32

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
IDO1 P14902 4/20 0.36
KDM4E B2RXH2 2/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
NQO1 P15559 1/20 0.34
NQO2 P16083 1/20 0.34
MCL1 Q07820 4/20 0.33
CNR2 P34972 3/20 0.33
CNR1 P21554 1/20 0.33
LSS P48449 1/20 0.33
PLA2G4A P47712 1/20 0.32
BRD4 O60885 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32

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
SCHEMBL6975925 0.84 PTGDR2 (0.41) LMNAKDM4EMCL1THRB
SCHEMBL7083107 0.82 IDO1 (0.33) LMNAIDO1PPARGPPARANQO1
SCHEMBL6975262 0.81 PIK3R1 (0.38) LMNAIDO1KDM4ENQO2MCL1
SCHEMBL6983087 0.81 LMNA (0.44) LMNAKDM4EMCL1MAPT
SCHEMBL6976583 0.81 LMNA (0.40) LMNAIDO1PPARGPPARAMCL1
SCHEMBL6979851 0.80 LMNA (0.41) LMNAIDO1KDM4ECNR2CNR1
SCHEMBL6984474 0.79 TNFRSF1A (0.36) LMNAIDO1KDM4EBRD4TP53
SCHEMBL6981368 0.79 LMNA (0.38) LMNACNR2CNR1MAPT
SCHEMBL6978066 0.76 GABRA1 (0.40) LMNABRD4MAPT
SCHEMBL6978829 0.76 GABRA1 (0.36) MAPT

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