SCHEMBL7374237

SCHEMBL7374237

CCOC(=O)CCCCCOc1cc(C)ccc1N(C)C(=O)c1ccc(NC(=O)c2ccccc2-c2ccc(C)cc2C)c(OC)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
NPSR1 Q6W5P4 3/20 0.37
TSHR P16473 1/20 0.37
MAPT P10636 5/20 0.37
HTT P42858 2/20 0.37
HSP90AA1 P07900 1/20 0.37
TP53 P04637 2/20 0.36
GAA P10253 2/20 0.36
ALDH1A1 P00352 4/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
ALOX12 P18054 1/20 0.35
MTTP P55157 1/20 0.35

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
SCHEMBL7369597 0.96 MEN1 (0.39) MEN1KMT2ATDP1NPSR1TSHR
SCHEMBL7377966 0.92 MTTP (0.41) MEN1KMT2ATDP1NPSR1TSHR
SCHEMBL7371186 0.92 AVPR2 (0.42) HTTTP53GAAALDH1A1L3MBTL1
SCHEMBL7370349 0.89 GAA (0.41) MEN1KMT2ANPSR1MAPTHTT
SCHEMBL7337480 0.88 TP53 (0.42) MEN1KMT2ATDP1NPSR1MAPT
SCHEMBL7374507 0.87 MAPT (0.43) MEN1KMT2ATDP1MAPTHTT
SCHEMBL7369948 0.87 MTTP (0.39) ALDH1A1HPGDMTTP
SCHEMBL7373265 0.86 AVPR2 (0.46) MTTP
SCHEMBL7373504 0.86 GAA (0.41) MEN1KMT2ATSHRMAPTTP53
SCHEMBL7377093 0.85 AVPR2 (0.43) NPSR1MAPTHTTHSP90AA1TP53

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-6211242-B1 CARDIOVASCULAR DISORDERS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-04-03 US disclosed
EP-0757670-B1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 1999-01-13 EP disclosed
WO-1995029152-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-02 WO disclosed