SCHEMBL7339155

SCHEMBL7339155

CCCOc1ccc(-c2ccc(-c3nnc(-c4ccc(C(=O)OC)cc4)o3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.61
KDM4E B2RXH2 8/20 0.61
ALDH1A1 P00352 8/20 0.61
NPC1 O15118 7/20 0.61
HPGD P15428 7/20 0.61
SMN1; SMN2 Q16637 7/20 0.61
HSD17B10 Q99714 6/20 0.61
MAPT P10636 7/20 0.57
TP53 P04637 5/20 0.55
TSHR P16473 3/20 0.55
CASP3 P42574 1/20 0.55
SENP8 Q96LD8 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
SENP6 Q9GZR1 1/20 0.55
LMNA P02545 1/20 0.54
NR1H4 Q96RI1 1/20 0.52
PLK1 P53350 1/20 0.49
POLB P06746 2/20 0.47
MEN1 O00255 1/20 0.47
CYP1A2 P05177 1/20 0.47

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
SCHEMBL7320882 0.95 MAPT (0.61) RAB9AKDM4EALDH1A1NPC1HPGD
SCHEMBL7320106 0.93 MAPT (0.59) RAB9AKDM4EALDH1A1NPC1HPGD
SCHEMBL7319130 0.91 RARB (0.59) RAB9AKDM4EALDH1A1NPC1HPGD
SCHEMBL7316044 0.91 RARB (0.59) RAB9AKDM4EALDH1A1NPC1HPGD
SCHEMBL7340342 0.90 NPC1 (0.59) RAB9AKDM4EALDH1A1NPC1HPGD
SCHEMBL7332034 0.90 NPC1 (0.59) RAB9AKDM4EALDH1A1NPC1HPGD
SCHEMBL14231641 0.88 MAPT (0.74) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL7324195 0.88 MAPT (0.55) RAB9AKDM4EALDH1A1NPC1HPGD
SCHEMBL7324703 0.88 MAPT (0.64) RAB9AKDM4EALDH1A1NPC1HPGD
SCHEMBL7321777 0.88 MAPT (0.64) RAB9AKDM4EALDH1A1NPC1HPGD

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