SCHEMBL7367645

SCHEMBL7367645

COC(=O)c1ccc(-c2nn(Cc3ccccc3)c(=O)c3ncccc23)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 1/20 0.55
ALDH1A1 P00352 6/20 0.54
HPGD P15428 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
PDE4A P27815 2/20 0.49
PDE4B Q07343 2/20 0.49
PDE4C Q08493 2/20 0.49
PDE4D Q08499 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
TSHR P16473 2/20 0.48
ENPP1 P22413 1/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 2/20 0.45
CYP2D6 P10635 1/20 0.45

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
SCHEMBL7369005 0.93 PDE4A (0.51) F2RL3ALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL7367052 0.92 F2RL3 (0.53) F2RL3ALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL7359391 0.89 MAPK10 (0.50) F2RL3ALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL7365466 0.88 ALDH1A1 (0.56) F2RL3ALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL7365662 0.87 HPGD (0.55) F2RL3ALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL7362202 0.86 ALDH1A1 (0.54) F2RL3ALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL7363597 0.86 ALDH1A1 (0.51) F2RL3ALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL7359750 0.85 PDE4A (0.50) F2RL3ALDH1A1PDE4APDE4BPDE4C
SCHEMBL7367933 0.85 ALDH1A1 (0.56) F2RL3ALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL7366890 0.85 PDE4A (0.55) ALDH1A1HPGDSMN1; SMN2KMT2AMEN1

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