SCHEMBL7330838

SCHEMBL7330838

CCCCCCc1ccc(-c2ccc(-c3nc4cc(C(=O)O)ccc4o3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 12/20 0.61
RARA P10276 2/20 0.61
MAPT P10636 2/20 0.61
MEN1 O00255 1/20 0.61
ALDH1A1 P00352 1/20 0.61
MTOR P42345 1/20 0.61
KMT2A Q03164 1/20 0.61
RARG P13631 1/20 0.51
HDAC6 Q9UBN7 2/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
MPL P40238 1/20 0.48
POLB P06746 1/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TP53 P04637 1/20 0.48
NFKB1 P19838 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
SCHEMBL2249412 0.90 RAB9A (0.53) MAPTMEN1ALDH1A1KMT2AHDAC6
SCHEMBL8303553 0.87 RARB (0.57) RARBRARAMAPTMEN1ALDH1A1
SCHEMBL7337596 0.87 MAPT (0.48) RARBRARAMAPTMEN1ALDH1A1
SCHEMBL14756113 0.86 RARB (0.55) RARBRARAMAPTMEN1ALDH1A1
SCHEMBL9379320 0.86 KDM4E (0.54) RARBRARAMAPTMEN1ALDH1A1
SCHEMBL8304830 0.85 RAB9A (0.54) MAPTMEN1ALDH1A1KMT2AHDAC6
SCHEMBL9001595 0.84 KDM4E (0.59) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL7333665 0.84 RARB (0.62) RARBMAPTHDAC6TP53
SCHEMBL8308595 0.84 RARB (0.62) RARBMAPTHDAC6TP53
SCHEMBL9797021 0.82 HDAC6 (0.65) MAPTHDAC6RAB9ASMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1203089-C New compound FUJISAWA PHARMACEUTICAL CO (JP) 2005-05-25 CN disclosed
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
CN-1168675-A Novel compounds FUJISAWA PHARMACEUTICAL CO (JP) 1997-12-24 CN 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