SCHEMBL7366436

SCHEMBL7366436

COC(=O)c1cccc(C(=O)c2ncccc2C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.51
ALDH1A1 P00352 5/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
ALOX15 P16050 2/20 0.51
TSHR P16473 2/20 0.51
CYP3A4 P08684 1/20 0.51
MAPT P10636 1/20 0.51
BLM P54132 1/20 0.51
AGER Q15109 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
KDM6B O15054 1/20 0.50
KDM5C P41229 1/20 0.50
KDM4C Q9H3R0 1/20 0.50
KDM2A Q9Y2K7 1/20 0.50
KDM3A Q9Y4C1 1/20 0.50
HTT P42858 2/20 0.48
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HPGD P15428 1/20 0.44

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
SCHEMBL7370453 0.92 ALOX15 (0.50) KDM4EALDH1A1L3MBTL1ALOX15KDM6B
SCHEMBL7369163 0.89 ALDH1A1 (0.54) KDM4EALDH1A1L3MBTL1ALOX15TSHR
SCHEMBL7362858 0.87 KDM4E (0.56) KDM4EALDH1A1L3MBTL1ALOX15TSHR
SCHEMBL7365118 0.86 ALOX15 (0.50) KDM4EALDH1A1L3MBTL1ALOX15TSHR
SCHEMBL7364528 0.84 HTT (0.56) KDM4EALDH1A1L3MBTL1ALOX15TSHR
SCHEMBL7369534 0.83 ALDH1A1 (0.48) KDM4EALDH1A1L3MBTL1ALOX15TSHR
SCHEMBL7370711 0.82 POLB (0.63) KDM4EALDH1A1L3MBTL1ALOX15TSHR
SCHEMBL7364891 0.81 TDP1 (0.56) KDM4EALDH1A1L3MBTL1ALOX15TSHR
SCHEMBL519094 0.81 KDM4E (0.67) KDM4EALDH1A1L3MBTL1ALOX15TSHR
SCHEMBL29559479 0.81 KDM4E (0.67) KDM4EALDH1A1L3MBTL1ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5716954-A ANTIINFLAMMATORY AGENT, ANTIHISTAMINES, IMMUNOSUPPRESSION,AUTOIMMUNE DISEASES SYNTEX U.S.A. INC. (US) 1998-02-10 US disclosed
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