SCHEMBL7340490

SCHEMBL7340490

COCCCCCCCCOc1ccc(N2CCN(c3ccc(C(=O)OC)cn3)CC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.66
NPC1 O15118 1/20 0.66
RAB9A P51151 1/20 0.66
MAPT P10636 5/20 0.48
MEN1 O00255 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CRBN Q96SW2 3/20 0.47
ALDH1A1 P00352 2/20 0.47
HIF1A Q16665 1/20 0.47
OGA O60502 1/20 0.46
ME2 P23368 1/20 0.46
ME1 P48163 1/20 0.46
ME3 Q16798 1/20 0.46
DDB1 Q16531 1/20 0.46
HRH3 Q9Y5N1 5/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 1/20 0.45

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
SCHEMBL7332750 0.93 KMT2A (0.65) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL7333979 0.93 KMT2A (0.65) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL7342988 0.93 KMT2A (0.65) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL7615805 0.90 KMT2A (0.55) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL7333300 0.81 TSHR (0.59) KMT2ANPC1RAB9AMAPTHPGD
SCHEMBL7331983 0.81 TSHR (0.59) KMT2ANPC1RAB9AMAPTHPGD
SCHEMBL7340806 0.81 KMT2A (0.79) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL9211056 0.80 KMT2A (1.00) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL22495207 0.80 RAB9A (0.67) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL27482234 0.79 MGAM (0.58) KMT2ANPC1RAB9AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0788511-B1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO (JP) 2002-12-11 EP disclosed
US-6265536-B1 MICROBIOCIDE AND FUNGICIDE WHICH IS INHIBITOR OF BETA-1,3-GLUCAN SYNTHASE; TREATMENT OF PNEUMOCYSTIS CARINII INFECTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-07-24 US disclosed
US-6107458-A FUNGICIDE WHICH IS BETA-1,3-GLYCAN SYNTHASE INHIBITOR; FOR PROPHYLAXIS AND TREATMENT OF PNEUMOCYSTIS CARINII INFECTIONS LIKE PNEUMONIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-08-22 US disclosed
EP-0788511-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-08-13 EP disclosed
WO-1996011210-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-04-18 WO disclosed