SCHEMBL6088018

SCHEMBL6088018

CCc1c(Sc2cc(C)cc(C)c2)n(Cc2cc(OC)cc(OC)c2)c(=O)[nH]c1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
HTT P42858 2/20 0.36
DHFR P00374 1/20 0.35
TYMS P04818 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
ALDH1A1 P00352 5/20 0.35
LMNA P02545 2/20 0.35
TP53 P04637 2/20 0.35
MAPK1 P28482 2/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HPGD P15428 3/20 0.34
KDM4E B2RXH2 2/20 0.34
GAA P10253 1/20 0.34
RAB9A P51151 1/20 0.34
NCOA1 Q15788 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL6087289 0.91 MTNR1A (0.48) MTNR1AMTNR1BADORA3KMT2AHPGD
SCHEMBL6087421 0.90 SMN1; SMN2 (0.37) HTTADORA3ALDH1A1TP53MAPK1
SCHEMBL6086770 0.84 GRIN1 (0.37) ALDH1A1KMT2AGAASMN1; SMN2GRIN1
SCHEMBL6088055 0.84 TYMS (0.38) HTTTYMSLMNAMAPK1TSHR
SCHEMBL6085656 0.84 SMN1; SMN2 (0.33) HTTDHFRTYMSADORA3ALDH1A1
SCHEMBL6086545 0.84 HPGD (0.43) HTTADORA3ALDH1A1MAPK1TSHR
SCHEMBL6086149 0.84 MTNR1A (0.35) MTNR1AMTNR1BHTTADORA3ALDH1A1
SCHEMBL7843309 0.83 HSD17B10 (0.38) MTNR1AMTNR1BHTTDHFRTYMS
SCHEMBL6086917 0.82 TSHR (0.34) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL7854341 0.82 TPH1 (0.33) HTTMAPK1TSHRMEN1KMT2A

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