SCHEMBL14611641

SCHEMBL14611641

CCOC(=O)c1cn(CCCC(C)(C)[Si](C)(C)O)c2c([N+](=O)[O-])cc(Cc3cccc(CI)c3F)cc2c1=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.38
▸ LMNA P02545 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ NPC1 O15118 1/20 0.34
▸ CNR2 P34972 3/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ STAT3 P40763 2/20 0.33
▸ HTT P42858 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ GNRHR P30968 2/20 0.32
▸ CMA1 P23946 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ TNF P01375 1/20 0.30

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
SCHEMBL14611643 0.92 ALDH1A1 (0.44) POLBLMNAALDH1A1MAPTNPC1
SCHEMBL14611646 0.89 KMT2A (0.34) LMNAALDH1A1MAPTCNR2KMT2A
SCHEMBL14611571 0.88 STAT3 (0.35) LMNAALDH1A1MAPTCNR2KMT2A
SCHEMBL14611804 0.83 KMT2A (0.38) POLBLMNAALDH1A1MAPTKMT2A
SCHEMBL12957467 0.82 POLB (0.46) POLBLMNAALDH1A1MAPTNPC1
SCHEMBL14611569 0.81 KMT2A (0.43) POLBLMNAALDH1A1MAPTCNR1
SCHEMBL14611570 0.81 KMT2A (0.34) POLBLMNAALDH1A1MAPTKMT2A
SCHEMBL11956462 0.80 STAT3 (0.35) POLBLMNAALDH1A1MAPTKMT2A
SCHEMBL11957341 0.79 CMA1 (0.39) POLBLMNAALDH1A1MAPTKMT2A
SCHEMBL11948586 0.79 ALDH1A1 (0.44) POLBLMNAALDH1A1MAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7176220-B2 4-oxoquinoline compound and use thereof as pharmaceutical agent JAPAN TOBACCO INC. (JP) 2007-02-13 — — US disclosed
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