SCHEMBL7283000

SCHEMBL7283000

CC(C)CCCOc1ccccc1-c1ccc([C]=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.45
ALDH1A1 P00352 5/20 0.45
HTR7 P34969 1/20 0.42
ADRB2 P07550 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
PKM P14618 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
IDO1 P14902 1/20 0.41
TP53 P04637 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 1/20 0.40
POLB P06746 1/20 0.39
PPIA P62937 1/20 0.39
DRD1 P21728 1/20 0.39

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
SCHEMBL8780384 0.84 HTR7 (0.58) KDM4EALDH1A1HTR7ADRB2SMN1; SMN2
SCHEMBL28600060 0.77 TDP1 (0.50) MEN1KMT2AMAPK1L3MBTL1HTT
SCHEMBL6539854 0.76 HTT (0.45) KDM4EALDH1A1SMN1; SMN2IDO1MAPK1
SCHEMBL19806810 0.75 HTT (0.51) KDM4EMEN1KMT2AIDO1LMNA
SCHEMBL27459272 0.74 HTR7 (0.51) KDM4EALDH1A1HTR7ADRB2SMN1; SMN2
SCHEMBL3969795 0.74 PTPRC (0.51) ALDH1A1
SCHEMBL27540487 0.72 SYK (0.48) KDM4EALDH1A1HTR7ADRB2IDO1
SCHEMBL3068735 0.71 TDP1 (0.56) ALDH1A1SMN1; SMN2KMT2ATP53MAPK1
SCHEMBL31019371 0.71 AR (0.46) KDM4EALDH1A1HTR7ADRB2SMN1; SMN2
SCHEMBL28481944 0.71 AR (0.46) KDM4EALDH1A1HTR7ADRB2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0644199-B1 Cyclic antimicrobial peptides and preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 2000-07-19 EP disclosed
US-5693750-A MICROBIOCIDAL ACTION AGAINST PNEUMOCYSTIS INFECTIONS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-12-02 US disclosed
US-5569646-A TREATMENT OF PNEUMONIA; MICROBIOCIDES, FUNGICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-29 US disclosed
EP-0644199-A1 Cyclic antimicrobial peptides and preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-03-22 EP disclosed