SCHEMBL7315490

SCHEMBL7315490

N#Cc1ccc(N2CCC(N3CCN(c4ccc(C5CCCCC5)cc4)CC3)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 3/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
MEN1 O00255 1/20 0.48
HRH3 Q9Y5N1 6/20 0.47
KDM4E B2RXH2 1/20 0.47
TP53 P04637 1/20 0.47
PDCD1 Q15116 1/20 0.45
CD274 Q9NZQ7 1/20 0.45
MBTD1 Q05BQ5 1/20 0.43
SLC18A3 Q16572 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL7333118 0.90 KDM4E (0.56) HRH3KDM4ETP53
SCHEMBL725292 0.84 L3MBTL3 (0.71) L3MBTL3L3MBTL1MEN1HRH3KDM4E
SCHEMBL10395267 0.83 L3MBTL3 (0.73) L3MBTL3L3MBTL1MEN1HRH3KDM4E
SCHEMBL5800431 0.83 KDM4E (0.61) L3MBTL3L3MBTL1MEN1HRH3KDM4E
SCHEMBL7339594 0.83 HPGD (0.54) MEN1HRH3KDM4ETP53SLC18A3
SCHEMBL6132351 0.82 SLC18A3 (0.63) HRH3SLC18A3
SCHEMBL7322330 0.81 L3MBTL3 (0.56) L3MBTL3L3MBTL1MBTD1SLC18A3KMT2A
SCHEMBL6538540 0.81 HRH3 (0.58) L3MBTL3L3MBTL1MEN1HRH3KDM4E
SCHEMBL7991862 0.79 L3MBTL3 (0.53) L3MBTL3L3MBTL1MEN1HRH3KDM4E
SCHEMBL7324507 0.78 L3MBTL3 (0.53) L3MBTL3L3MBTL1MEN1HRH3KDM4E

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-6232290-B1 FUNGICIDES AGAINST PNEUMOCYSTIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-15 US disclosed
EP-1053247-A1 ANTIFUNGAL CYCLOHEXAPEPTIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-11-22 EP disclosed
WO-1999040108-A1 NEW COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-08-12 WO disclosed