SCHEMBL7361928

SCHEMBL7361928

Cc1ccc(-c2ncccc2C(=O)O)c(CO)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.55
HTT P42858 1/20 0.55
TDP1 Q9NUW8 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.47
TP53 P04637 1/20 0.47
ALDH1A1 P00352 6/20 0.43
GAA P10253 3/20 0.43
LMNA P02545 2/20 0.42
POLB P06746 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
BLM P54132 1/20 0.41
AGER Q15109 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MYC P01106 1/20 0.40
NAPRT Q6XQN6 2/20 0.40
DHODH Q02127 1/20 0.39

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
SCHEMBL7367688 0.85 KDM4E (0.54) KDM4EHTTTDP1SMN1; SMN2ALDH1A1
SCHEMBL7366150 0.83 KDM4E (0.49) KDM4EHTTTDP1SMN1; SMN2ALDH1A1
SCHEMBL7369692 0.82 KDM4E (0.50) KDM4EHTTTDP1SMN1; SMN2ALDH1A1
SCHEMBL7366979 0.81 KDM4E (0.47) KDM4EHTTTDP1SMN1; SMN2ALDH1A1
SCHEMBL7367740 0.81 KDM4E (0.47) KDM4EHTTTDP1SMN1; SMN2ALDH1A1
SCHEMBL7364363 0.75 KDM4E (0.51) KDM4EHTTTDP1SMN1; SMN2TP53
SCHEMBL28420021 0.73 PDE3B (0.48) KDM4EHTTTDP1SMN1; SMN2TP53
SCHEMBL7365920 0.73 KDM4E (0.57) KDM4ETDP1SMN1; SMN2ALDH1A1GAA
SCHEMBL14564497 0.73 KDM4E (0.67) KDM4ETDP1SMN1; SMN2TP53ALDH1A1
SCHEMBL7365914 0.73 KDM4E (0.61) KDM4ETDP1SMN1; SMN2ALDH1A1GAA

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