SCHEMBL8784229

SCHEMBL8784229

CCOC(=O)c1c(-c2ccccc2C(F)(F)F)c2cc(Cl)ccc2oc1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.49
ALDH1A1 P00352 5/20 0.48
ALOX5 P09917 6/20 0.46
CSF1R P07333 1/20 0.44
KDM4E B2RXH2 4/20 0.44
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
MAOA P21397 1/20 0.43
HIF1A Q16665 1/20 0.42
LDHA P00338 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 2/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41
MAPT P10636 2/20 0.40
APAF1 O14727 1/20 0.40
MITF O75030 1/20 0.40
LMNA P02545 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
SCHEMBL9157232 0.87 ALOX5 (0.56) MAOBALDH1A1ALOX5CSF1RKDM4E
SCHEMBL8786260 0.87 MAOB (0.54) MAOBALDH1A1ALOX5CSF1RKDM4E
SCHEMBL8784318 0.84 MAOA (0.48) ALDH1A1KDM4EMAOAL3MBTL1LMNA
SCHEMBL8785663 0.84 ALOX5 (0.57) MAOBALDH1A1ALOX5CSF1RKDM4E
SCHEMBL8785092 0.82 CSF1R (0.63) MAOBALDH1A1ALOX5CSF1RKDM4E
SCHEMBL9153220 0.79 ALOX5 (0.58) MAOBALDH1A1ALOX5KDM4EGLA
SCHEMBL8784890 0.78 LMNA (0.43) MAOBALDH1A1KDM4EGLAGAA
SCHEMBL8784023 0.78 TACR1 (0.53)
SCHEMBL8786205 0.78 MAOA (0.46) ALDH1A1KDM4EMAOALMNASMN1; SMN2
SCHEMBL8402597 0.77 KDM4E (0.55) ALDH1A1KDM4EGAAMAOAHIF1A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0585913-B1 Condensed heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1997-12-29 EP disclosed
US-5700810-A Condensed heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-12-23 US disclosed
US-5482967-A LOWERING CHOLESTEROL TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-01-09 US disclosed
EP-0585913-A2 Condensed heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-03-09 EP disclosed