SCHEMBL8364421

SCHEMBL8364421

Cc1nc2cccc(C(=O)O)c2n1-c1ccc(-c2ccccc2-c2nc(=O)s[nH]2)c(C2CC2)c1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.34
DHODH Q02127 1/20 0.34
MAPK1 P28482 1/20 0.34
NOTUM Q6P988 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
POLB P06746 1/20 0.32
RECQL P46063 1/20 0.32
RORC P51449 1/20 0.32

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
SCHEMBL8363473 0.86 LMNA (0.35) HSD17B10DHODHMAPK1NOTUMLMNA
SCHEMBL8359915 0.83 DHODH (0.34) HSD17B10DHODHMAPK1NOTUMLMNA
SCHEMBL8359337 0.81 PTPN11 (0.37) DHODHLMNA
SCHEMBL8364419 0.78 DYRK1A (0.34) HSD17B10
SCHEMBL8361952 0.77 TSHR (0.38) HSD17B10LMNAMAPTPOLB
SCHEMBL8357460 0.75 TSHR (0.38) HSD17B10LMNAKDM4EPOLB
SCHEMBL8364433 0.73 AGTR2 (0.34)
SCHEMBL7017227 0.71
SCHEMBL8587862 0.71 ALOX15 (0.37) HSD17B10DHODHMAPK1
SCHEMBL8422155 0.71 DHODH (0.38) HSD17B10DHODHMAPK1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5883111-A STRONG AND LONG-LASTING ACTION BY ORAL ADMINISTRATION; HYPOTENSIVE AGENTS; CARDIOTONIC AGENTS; ALZHEIMER'S DISEASE; TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-16 US disclosed
US-5736555-A HYPOTENSIVE AGENTS; FDA ORANGE BOOK LISTED PATENT FOR AZILSARTAN MEDOXOMIL TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-04-07 US disclosed