SCHEMBL7367891

SCHEMBL7367891

COC(=O)c1ccc(C(=O)c2ncccc2C(=O)OC)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
HTT P42858 2/20 0.50
ALOX15 P16050 1/20 0.50
ALDH1A1 P00352 4/20 0.49
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
KDM4E B2RXH2 5/20 0.48
POLB P06746 1/20 0.48
MAP2K1 Q02750 1/20 0.47
TSHR P16473 1/20 0.46
EGLN1 Q9GZT9 1/20 0.45
PKM P14618 2/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 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
SCHEMBL7362858 0.91 KDM4E (0.56) MEN1KMT2AHTTALOX15ALDH1A1
SCHEMBL7360249 0.91 KDM4E (0.51) MEN1KMT2AHTTALOX15ALDH1A1
SCHEMBL7366038 0.91 KDM4E (0.50) MEN1KMT2AHTTALOX15ALDH1A1
SCHEMBL7364891 0.91 TDP1 (0.56) KMT2AHTTALOX15ALDH1A1MAPT
SCHEMBL10480570 0.90 CYP1A2 (0.51) MEN1KMT2AHTTALOX15ALDH1A1
SCHEMBL7368578 0.90 CA1 (0.51) MEN1KMT2AHTTALDH1A1MAPT
SCHEMBL7369472 0.90 TDP1 (0.46) MEN1KMT2AHTTALOX15ALDH1A1
SCHEMBL7368006 0.88 L3MBTL1 (0.53) MEN1KMT2AHTTALOX15ALDH1A1
SCHEMBL7369036 0.87 TDP1 (0.44) MEN1KMT2AHTTALOX15ALDH1A1
SCHEMBL7370453 0.87 ALOX15 (0.50) MEN1KMT2AHTTALOX15ALDH1A1

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