SCHEMBL7364363

SCHEMBL7364363

Cc1ccc(-c2ncccc2C(=O)O)c(CO)c1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.51
TDP1 Q9NUW8 1/20 0.51
HTT P42858 1/20 0.43
ALDH1A1 P00352 5/20 0.40
LMNA P02545 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
TP53 P04637 1/20 0.40
MYC P01106 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
BLM P54132 1/20 0.40
AGER Q15109 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL7369401 0.89 KDM4E (0.46) KDM4ETDP1HTTALDH1A1LMNA
SCHEMBL7366019 0.82 KDM4E (0.46) KDM4ETDP1HTTALDH1A1LMNA
SCHEMBL7365914 0.80 KDM4E (0.61) KDM4ETDP1ALDH1A1LMNASMN1; SMN2
SCHEMBL7363319 0.76 KDM4E (0.54) KDM4ETDP1ALDH1A1LMNASMN1; SMN2
SCHEMBL7365254 0.76 KDM4E (0.54) KDM4ETDP1ALDH1A1LMNASMN1; SMN2
SCHEMBL7365354 0.75 TDP1 (0.50) KDM4ETDP1HTTALDH1A1MAPT
SCHEMBL7362874 0.75 KDM4E (0.50) KDM4ETDP1HTTALDH1A1SMN1; SMN2
SCHEMBL7361928 0.75 KDM4E (0.55) KDM4ETDP1HTTALDH1A1LMNA
SCHEMBL10000544 0.74 KDM4E (0.65) KDM4ETDP1ALDH1A1LMNASMN1; SMN2
SCHEMBL27792955 0.73 HAAO (0.39) KDM4ETDP1ALDH1A1KMT2AMYC

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 2 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
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