SCHEMBL6677394

SCHEMBL6677394

O=C(O)C1(c2ccccc2)C=CC(F)(Cl)C=C1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 1/20 0.37
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
HTT P42858 2/20 0.33
LMNA P02545 1/20 0.33
MAOB P27338 5/20 0.31
MAOA P21397 3/20 0.31
NPSR1 Q6W5P4 2/20 0.31
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HSD11B1 P28845 1/20 0.31
HDAC4 P56524 1/20 0.31
THRB P10828 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL28890126 0.85 AKR1C1 (0.46) AKR1C1KMT2AHTTLMNAHSD11B1
SCHEMBL6680771 0.81 AKR1C1 (0.37) AKR1C1MEN1KMT2AHTTLMNA
SCHEMBL6681685 0.80 AKR1C1 (0.34) AKR1C1MEN1KMT2AHTTLMNA
SCHEMBL5614157 0.77 HCAR3 (0.36) AKR1C1MEN1KMT2ALMNACYP1A2
SCHEMBL6677871 0.73 AKR1C1 (0.34) AKR1C1MEN1KMT2AHTTCYP1A2
SCHEMBL6677071 0.73 SMN1; SMN2 (0.36) MEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL6679022 0.73 HCAR3 (0.33) AKR1C1MEN1KMT2AHTTLMNA
SCHEMBL6679652 0.72 CES2 (0.36) AKR1C1MEN1KMT2AHTTNPSR1
SCHEMBL29031869 0.71 ALOX15 (0.44) MEN1KMT2ALMNACYP2C9CYP2C19
SCHEMBL6677414 0.70 KMT2A (0.40) AKR1C1MEN1KMT2AHTTLMNA

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
EP-1472226-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-03 EP disclosed
WO-2003045921-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-06-05 WO disclosed