SCHEMBL9214367

SCHEMBL9214367

O=C(O)c1ccc(Cl)cc1C(=O)c1cccc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR4A1 P22736 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ CASP1 P29466 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ CDC25A P30304 1/20 0.51
▸ CDC25B P30305 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ SRD5A2 P31213 1/20 0.50
▸ CA1 P00915 1/20 0.50
▸ CA2 P00918 1/20 0.50
▸ PARP1 P09874 1/20 0.50
▸ POLB P06746 1/20 0.50
▸ AKR1C3 P42330 2/20 0.49
▸ SERPINE1 P05121 2/20 0.49
▸ AKR1C4 P17516 1/20 0.49
▸ AKR1C2 P52895 1/20 0.49

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
SCHEMBL4712301 0.89 NR4A1 (0.68) NR4A1KDM4EALDH1A1TP53TSHR
SCHEMBL30704729 0.88 NR4A1 (0.66) NR4A1KDM4EALDH1A1SMN1; SMN2CDC25A
SCHEMBL9197822 0.88 NR4A1 (0.66) NR4A1KDM4EALDH1A1SMN1; SMN2CDC25A
SCHEMBL9207086 0.87 POLB (0.69) NR4A1KDM4EALDH1A1TP53TSHR
SCHEMBL11731147 0.84 NR4A1 (0.70) NR4A1KDM4EALDH1A1TP53TSHR
SCHEMBL3956037 0.82 NR4A1 (0.68) NR4A1KDM4EALDH1A1TP53TSHR
SCHEMBL11851861 0.82 SRD5A2 (0.62) KDM4EALDH1A1TP53TSHRCASP1
SCHEMBL28157462 0.82 NR4A1 (0.61) NR4A1KDM4EALDH1A1TP53SMN1; SMN2
SCHEMBL10940788 0.81 ALOX15 (0.54) NR4A1ALDH1A1ALOX15PARP1POLB
SCHEMBL16363711 0.81 POLB (0.60) NR4A1ALDH1A1TP53CDC25ACDC25B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0569457-B1 USE OF THIAZOLO-[2,3-A]ISOINDOLE DERIVATIVES AS ANTIVIRAL MEDICAMENTS AND NOVEL THIAZOLO- [2,3-A]ISOINDOLE DERIVATIVES BOEHRINGER MANNHEIM GMBH (DE) 1995-06-14 — — EP disclosed
EP-0569457-A1 USE OF THIAZOLO- 2,3-A]ISOINDOLE DERIVATIVES AS ANTIVIRAL MEDICAMENTS AND NOVEL THIAZOLO- 2,3-A]ISOINDOLE DERIVATIVES. BOEHRINGER MANNHEIM GMBH (DE) 1993-11-18 — — EP disclosed
WO-1992013863-A1 USE OF THIAZOLO-[2,3-A]ISOINDOLE DERIVATIVES AS ANTIVIRAL MEDICAMENTS AND NOVEL THIAZOLO-[2,3-A]ISOINDOLE DERIVATIVES BOEHRINGER MANNHEIM GMBH (DE) 1992-08-20 — — WO disclosed
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