SCHEMBL7845760

SCHEMBL7845760

CCCC=C1SC(=O)N(CCCCSc2cccc3ncc(C(=O)C(F)(F)F)n23)C1=O

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SPHK2 Q9NRA0 1/20 0.35
▸ MYC P01106 2/20 0.33
▸ CISD1 Q9NZ45 2/20 0.31
▸ LMNA P02545 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
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ MMP1 P03956 1/20 0.30
▸ MMP2 P08253 1/20 0.30
▸ MMP13 P45452 1/20 0.30
▸ MMP14 P50281 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
SCHEMBL7845758 1.00 SPHK2 (0.35) SPHK2MYCCISD1LMNANPC1
Hydrochloric Acid SCHEMBL7847128 0.99 SPHK2 (0.34) SPHK2MYCCISD1LMNANPC1
Hydrochloric Acid SCHEMBL7847125 0.99 SPHK2 (0.34) SPHK2MYCCISD1LMNANPC1
SCHEMBL7847718 0.84 SPHK2 (0.38) SPHK2MYCCISD1LMNANPC1
SCHEMBL7847716 0.84 SPHK2 (0.38) SPHK2MYCCISD1LMNANPC1
Hydrochloric Acid SCHEMBL7844089 0.83 SPHK2 (0.37) SPHK2MYCCISD1
Hydrochloric Acid SCHEMBL7844091 0.83 SPHK2 (0.37) SPHK2MYCCISD1
SCHEMBL7844613 0.81 SPHK2 (0.36) SPHK2CISD1
SCHEMBL7844616 0.81 SPHK2 (0.36) SPHK2CISD1
Hydrochloric Acid SCHEMBL7845116 0.81 SPHK2 (0.35) SPHK2CISD1

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
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