SCHEMBL7330984

SCHEMBL7330984

CCCCCc1ccc(-c2ccc(CCC(=O)OC)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.59
ALDH1A1 P00352 2/20 0.58
RARA P10276 2/20 0.58
MEN1 O00255 1/20 0.58
MAPT P10636 1/20 0.58
MTOR P42345 1/20 0.58
KMT2A Q03164 1/20 0.58
RARG P13631 1/20 0.50
HRH3 Q9Y5N1 1/20 0.50
FAAH O00519 1/20 0.49
S1PR1 P21453 2/20 0.48
S1PR3 Q99500 2/20 0.48
S1PR2 O95136 1/20 0.48
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48

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
SCHEMBL7339563 0.98 RARB (0.60) RARBALDH1A1RARAMEN1MAPT
SCHEMBL26239854 0.95 ALDH1A1 (0.56) RARBALDH1A1FAAHS1PR1S1PR3
SCHEMBL26239880 0.93 FAAH (0.55) RARBALDH1A1RARAMEN1MAPT
SCHEMBL27357681 0.93 FAAH (0.55) RARBALDH1A1RARAMEN1MAPT
SCHEMBL26239833 0.90 ALDH1A1 (0.55) RARBALDH1A1THRATHRB
SCHEMBL26239859 0.88 ALDH1A1 (0.56) RARBALDH1A1FAAHS1PR1S1PR3
SCHEMBL7340690 0.87 RARB (0.56) RARBS1PR1S1PR3
SCHEMBL25169991 0.87 FAAH (0.59) RARBALDH1A1RARAMEN1MAPT
SCHEMBL26239962 0.87 FAAH (0.55) RARBALDH1A1RARAMEN1MAPT
SCHEMBL23512353 0.85 HSD17B10 (0.54) ALDH1A1MAPTKMT2AHRH3

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