SCHEMBL6087657

SCHEMBL6087657

CCc1c(Oc2cc(C)cc(C)c2)n(Cc2nc3ccccc3o2)c(=O)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.39
CNR2 P34972 4/20 0.37
RAB9A P51151 2/20 0.36
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HCRTR2 O43614 1/20 0.35
PIK3CD O00329 1/20 0.34
PIK3CB P42338 1/20 0.34
NPC1 O15118 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
DRD1 P21728 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33

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
SCHEMBL6087401 0.86 HCRTR2 (0.38) TP53CNR2RAB9AMAPTSMN1; SMN2
SCHEMBL7848837 0.85 TP53 (0.39) TP53CNR2RAB9AMAPTSMN1; SMN2
SCHEMBL6089793 0.81 RAB9A (0.38) TP53CNR2RAB9AMAPTSMN1; SMN2
SCHEMBL6086262 0.81 TP53 (0.39) TP53RAB9AMAPTHCRTR2PIK3CD
SCHEMBL6086356 0.81 PDE10A (0.42) DRD1ALDH1A1
SCHEMBL6086864 0.81 HPGD (0.44) MAPTMEN1KMT2AALDH1A1
SCHEMBL6087014 0.78 DAO (0.46) MAPTMEN1KMT2AALDH1A1
SCHEMBL6088271 0.78 NPBWR1 (0.35) MAPTSMN1; SMN2MEN1KMT2ADRD1
SCHEMBL6086584 0.78 DCTPP1 (0.34) SMN1; SMN2MEN1KMT2ADRD1ALDH1A1
SCHEMBL6088051 0.77 GRIN1 (0.45) DRD1GABRA5

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-6987114-B1 Antiviral pyrimidinedione derivatives and process for the preparation thereof SAMJIN PHARMACEUTICAL CO., LTD (KR) 2006-01-17 US disclosed