SCHEMBL7848685

SCHEMBL7848685

CCCC=C1SC(=O)N(CCCCSc2cccc3nccn23)C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 1/20 0.39
CISD1 Q9NZ45 2/20 0.38
HSD17B10 Q99714 1/20 0.34
MYC P01106 1/20 0.31
LMNA P02545 3/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
NPC1 O15118 1/20 0.31
MITF O75030 1/20 0.31
HPGD P15428 1/20 0.31
XBP1 P17861 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
GFER P55789 1/20 0.31
MAPT P10636 2/20 0.31
PKM P14618 1/20 0.31
MAPK1 P28482 2/20 0.31
MAOA P21397 2/20 0.31
MAOB P27338 2/20 0.31
ALDH1A1 P00352 1/20 0.30
POLB P06746 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
SCHEMBL7848684 1.00 SPHK2 (0.39) SPHK2CISD1HSD17B10MYCLMNA
Hydrochloric Acid SCHEMBL7847506 0.99 SPHK2 (0.38) SPHK2CISD1HSD17B10MYCLMNA
Hydrochloric Acid SCHEMBL7847508 0.99 SPHK2 (0.38) SPHK2CISD1HSD17B10MYCLMNA
SCHEMBL7849255 0.97 SPHK2 (0.39) SPHK2CISD1HSD17B10LMNASMN1; SMN2
SCHEMBL7849253 0.97 SPHK2 (0.39) SPHK2CISD1HSD17B10LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL7842323 0.96 SPHK2 (0.39) SPHK2CISD1HSD17B10LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL7842324 0.96 SPHK2 (0.39) SPHK2CISD1HSD17B10LMNASMN1; SMN2
SCHEMBL7833911 0.95 SPHK2 (0.40) SPHK2CISD1HSD17B10MYCLMNA
SCHEMBL7833913 0.95 SPHK2 (0.40) SPHK2CISD1HSD17B10MYCLMNA
Hydrochloric Acid SCHEMBL7835084 0.95 SPHK2 (0.40) SPHK2CISD1HSD17B10MYCLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0767790-B1 CONDENSED IMIDAZOLE COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-12-12 EP disclosed
US-5840732-A ANTIDIABETIC AGENTS, AUTOIMMUNE DISEASES OR IMMUNOSUPPRESSANTS TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 1998-11-24 US disclosed
EP-0767790-A1 CONDENSED IMIDAZOLE COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-04-16 EP disclosed
WO-1995035296-A1 CONDENSED IMIDAZOLE COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-12-28 WO disclosed