SCHEMBL4359140

SCHEMBL4359140

Nc1ccc2c(C=O)cccc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 2/20 0.53
ALDH1A1 P00352 4/20 0.43
HSD17B10 Q99714 4/20 0.43
CYP3A4 P08684 3/20 0.43
CASP1 P29466 4/20 0.42
TDP1 Q9NUW8 2/20 0.42
ALOX15 P16050 2/20 0.42
CASP7 P55210 2/20 0.42
HBB P68871 1/20 0.42
HIF1A Q16665 1/20 0.42
KDM4E B2RXH2 2/20 0.40
TP53 P04637 2/20 0.40
MAPT P10636 2/20 0.40
HSP90AA1 P07900 1/20 0.40
HSP90AB1 P08238 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40

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
SCHEMBL5748858 0.86 ALDH1A1 (0.55) PLAUALDH1A1HSD17B10CYP3A4CASP1
SCHEMBL5745458 0.86 ALDH1A1 (0.55) PLAUALDH1A1HSD17B10CYP3A4CASP1
SCHEMBL29957764 0.85 CTDSP1 (0.53) PLAUALDH1A1HSD17B10CYP3A4CASP1
SCHEMBL9096655 0.78 ERN1 (0.44) PLAUALDH1A1HSD17B10CYP3A4CASP1
SCHEMBL1666511 0.78 KIF11 (0.42) ALDH1A1HSD17B10TDP1KDM4EMEN1
SCHEMBL1817898 0.77 MEN1 (0.48) ALDH1A1HSD17B10CYP3A4TDP1KDM4E
SCHEMBL9437612 0.77 CYP1A2 (0.57) ALDH1A1HSD17B10TDP1KDM4ETSHR
SCHEMBL4866312 0.77 TDP1 (0.48) HSD17B10TDP1MAPTHTTSMN1; SMN2
SCHEMBL29955696 0.77 CYP1A2 (0.57) ALDH1A1HSD17B10TDP1KDM4ETSHR
SCHEMBL9851160 0.77 TYMS (0.45) PLAUALDH1A1HSD17B10CYP3A4CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
EP-2754657-B1 LUMINESCENT SUBSTRATE FOR LUCIFERASE UNIV ELECTRO COMMUNICATIONS (JP) 2016-03-23 EP disclosed
US-8962854-B2 Luminescent substrate for luciferase THE UNIVERSITY OF ELECTRO-COMMUNICATIONS (JP) 2015-02-24 US disclosed
US-20140221665-A1 LUMINESCENT SUBSTRATE FOR LUCIFERASE THE UNIVERSITY OF ELECTRO-COMMUNICATIONS (JP) 2014-08-07 US disclosed
EP-2045252-B1 Derivatives of 1,2-dihydro-7-hydroxyquinolines containing fused rings LIFE TECHNOLOGIES CORP (US) 2013-05-01 EP disclosed
EP-2045252-A2 Derivatives of 1,2-dihydro-7-hydroxyquinolines containing fused rings Molecular Probes, Inc. (US) 2009-04-08 EP disclosed
EP-0323441-B1 5-Fluorouracil derivatives OTSUKA PHARMA CO LTD (JP) 1996-04-24 EP disclosed
EP-0436902-B1 5-Fluorouracil derivatives OTSUKA PHARMA CO LTD (JP) 1995-06-28 EP disclosed
US-5155113-A Administering 5-fluorouracil and derivatives with pyridine and pyridone derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-10-13 US disclosed
EP-0180188-B1 A COMPOSITION FOR INCREASING THE ANTI-CANCER ACTIVITY OF AN ANTI-CANCER COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-04-15 EP disclosed
EP-0180897-B1 5-FLUOROURACIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-08-07 EP disclosed
EP-0436902-A1 5-Fluorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-07-17 EP disclosed
US-4983609-A Anticancer agents OTSUKA PHARMACEUTICAL (JP) 1991-01-08 US disclosed
US-4864021-A ANTICARCINOGENIC AGENTS, ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-09-05 US disclosed
EP-0323441-A2 5-Fluorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-07-05 EP disclosed
EP-0180897-A2 5-Fluorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-05-14 EP disclosed
EP-0180188-A2 A composition for increasing the anti-cancer activity of an anti-cancer compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-05-07 EP disclosed
US-4151174-A 1:1 Adducts of indole and (na)phthalaldehydic acid POLAROID CORPORATION (US) 1979-04-24 US disclosed
US-4036863-A Trinapthylmethane compounds POLAROID CORPORATION (US) 1977-07-19 US disclosed
US-3976662-A 1:1 Adducts of 1-naphthol and (Na)phthalaldehydic acid POLAROID CORPORATION (US) 1976-08-24 US disclosed