SCHEMBL6086545

SCHEMBL6086545

CCc1c(Sc2cc(C)cc(C)c2)n(Cc2ccccc2)c(=O)[nH]c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.43
KMT2A Q03164 4/20 0.43
TSHR P16473 4/20 0.43
KDM4E B2RXH2 4/20 0.43
MEN1 O00255 3/20 0.43
PSMD14 O00487 1/20 0.43
HTT P42858 1/20 0.43
MAPK1 P28482 1/20 0.42
ADORA3 P0DMS8 2/20 0.41
ALDH1A1 P00352 2/20 0.41
BRD4 O60885 1/20 0.40
HSD17B10 Q99714 2/20 0.39
GAA P10253 1/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
C5AR1 P21730 1/20 0.39
TPH1 P17752 1/20 0.39
TPH2 Q8IWU9 1/20 0.39
BRAF P15056 1/20 0.38

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
SCHEMBL6087421 0.91 SMN1; SMN2 (0.37) HPGDKMT2ATSHRKDM4EMEN1
SCHEMBL6086507 0.89 DAO (0.45) HPGDKMT2ATSHRKDM4EMEN1
SCHEMBL6085656 0.88 SMN1; SMN2 (0.33) HPGDKMT2ATSHRKDM4EMEN1
SCHEMBL6086881 0.87 SMN1; SMN2 (0.42) HPGDKMT2ATSHRKDM4EMEN1
SCHEMBL6087645 0.87 GRIN1 (0.44) HPGDMAPK1ADORA3ALDH1A1POLB
SCHEMBL6086770 0.86 GRIN1 (0.37) KMT2AALDH1A1GAATPH1TPH2
SCHEMBL6088055 0.86 TYMS (0.38) HPGDKMT2ATSHRKDM4EMEN1
SCHEMBL6087289 0.86 MTNR1A (0.48) HPGDKMT2AADORA3HSD17B10POLB
SCHEMBL7854341 0.85 TPH1 (0.33) HPGDKMT2ATSHRKDM4EMEN1
SCHEMBL7758840 0.85 ALDH1A1 (0.51) HPGDKMT2ATSHRKDM4EMEN1

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