SCHEMBL7981903

SCHEMBL7981903

CCOC(=O)Cn1c(CC)nc2c(OCc3ccc(OC)cc3)cccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
ALDH1A1 P00352 6/20 0.45
HSD17B10 Q99714 4/20 0.45
MAPT P10636 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ALOX15 P16050 1/20 0.45
CACNA1B Q00975 1/20 0.45
APBA1 Q02410 1/20 0.45
KDM4E B2RXH2 5/20 0.42
HPGD P15428 3/20 0.41
TSHR P16473 1/20 0.41
SAE1 Q9UBE0 1/20 0.41
UBA2 Q9UBT2 1/20 0.41
HTT P42858 3/20 0.41
HDAC3 O15379 2/20 0.41
HDAC4 P56524 2/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC7 Q8WUI4 2/20 0.41
HDAC2 Q92769 2/20 0.41

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
SCHEMBL7975769 0.76 ALDH1A1 (0.51) ALDH1A1HSD17B10MAPTMEN1KMT2A
SCHEMBL7981661 0.72 BDKRB2 (0.48) ALDH1A1MAPTKDM4E
SCHEMBL13742251 0.68 ALDH1A1 (0.44) POLBALDH1A1HSD17B10MAPTMEN1
SCHEMBL3166559 0.68 GSK3B (0.46) HSD17B10MAPTKDM4ETSHRHTT
SCHEMBL11263773 0.68 MEN1 (0.72) POLBALDH1A1MAPTMEN1KMT2A
SCHEMBL3178001 0.68 ABCB1 (0.52) POLBALDH1A1HSD17B10MAPTKDM4E
SCHEMBL2390980 0.67 LMNA (0.54) ALDH1A1MAPTHPGDHTT
SCHEMBL660162 0.67 ABCB1 (0.40) MAPTMEN1KMT2ATSHRHTT
SCHEMBL7978844 0.67 RHEB (0.49) ALDH1A1MAPTMEN1KMT2AHTR1A
SCHEMBL18969785 0.66 RECQL (0.56) ALDH1A1HSD17B10MAPTMEN1KMT2A

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-6194396-B1 ANTIALLERGENS; ANTIINFLAMMATION AGENTS; AUTOIMMUNE DISEASE; ANTISHOCK AGENTS; ANALGESICS; E.G., A 4 OR 7-PHENYLALKYLENE-OXYBENZIMIDAZOLE UNSUBSTITUTED OR SUBSTITUTED IN THE 1,2,3-POSITION WITH AN OXY, AMINO AND/OR THIO GROUP FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-02-27 US disclosed
US-6083961-A FOR PREVENTION AND/OR TREATMENT OF BRADYKININ OR ITS ANALOGUES MEDIATED DISEASES SUCH AS ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASE, SHOCK, PAIN FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-07-04 US disclosed
EP-0774462-A1 HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-21 EP disclosed