SCHEMBL7360249

SCHEMBL7360249

COC(=O)c1cccnc1C(=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.51
ALDH1A1 P00352 4/20 0.51
TDP1 Q9NUW8 2/20 0.50
L3MBTL1 Q9Y468 4/20 0.47
ALOX15 P16050 2/20 0.47
MAPT P10636 2/20 0.47
CYP3A4 P08684 1/20 0.47
TSHR P16473 1/20 0.47
BLM P54132 1/20 0.47
AGER Q15109 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
PKM P14618 1/20 0.46
DHODH Q02127 1/20 0.45
HTT P42858 2/20 0.44
MAP2K1 Q02750 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KDM6B O15054 1/20 0.43

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
SCHEMBL7364891 0.91 TDP1 (0.56) KDM4EALDH1A1TDP1L3MBTL1ALOX15
SCHEMBL7367891 0.91 MEN1 (0.52) KDM4EALDH1A1TDP1L3MBTL1ALOX15
SCHEMBL7367762 0.88 L3MBTL1 (0.50) KDM4EALDH1A1TDP1L3MBTL1ALOX15
SCHEMBL7362858 0.88 KDM4E (0.56) KDM4EALDH1A1TDP1L3MBTL1ALOX15
SCHEMBL7366038 0.88 KDM4E (0.50) KDM4EALDH1A1TDP1L3MBTL1ALOX15
SCHEMBL10480570 0.87 CYP1A2 (0.51) KDM4EALDH1A1TDP1L3MBTL1ALOX15
SCHEMBL7369472 0.87 TDP1 (0.46) KDM4EALDH1A1TDP1L3MBTL1ALOX15
SCHEMBL7368578 0.87 CA1 (0.51) KDM4EALDH1A1TDP1L3MBTL1MAPT
SCHEMBL7369036 0.85 TDP1 (0.44) KDM4EALDH1A1TDP1L3MBTL1ALOX15
SCHEMBL519095 0.84 KDM4E (0.67) KDM4EALDH1A1TDP1L3MBTL1ALOX15

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