SCHEMBL11049820

SCHEMBL11049820

[Li]c1cc(C)c2cc(OC)ccc2n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.62
▸ KDM4E B2RXH2 7/20 0.52
▸ ALDH1A1 P00352 4/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ HPGD P15428 2/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ GLA P06280 1/20 0.52
▸ GAA P10253 1/20 0.52
▸ LMNA P02545 3/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ NQO2 P16083 2/20 0.49
▸ HTT P42858 1/20 0.48
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ RAD52 P43351 1/20 0.47
▸ BCHE P06276 3/20 0.46

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
SCHEMBL8103092 0.82 POLB (0.66) POLBKDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL7521559 0.81 POLB (0.64) POLBKDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL9849499 0.79 POLB (0.62) POLBKDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL2531203 0.79 POLB (0.62) POLBKDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL28026104 0.77 POLB (0.59) POLBKDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL25245924 0.76 NT5E (0.58) POLBKDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL10263305 0.76 KDM4E (0.73) POLBKDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL30460713 0.76 NT5E (0.58) POLBKDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL875697 0.74 KDM4E (0.58) POLBKDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL3111650 0.73 POLB (0.71) POLBKDM4EALDH1A1SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0035820-B1 NOVEL QUINOLINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH COMPOUNDS, AND METHOD FOR THE PREPARATION OF THESE COMPOUNDS ACF CHEMIEFARMA NV (NL) 1984-10-10 — — EP disclosed
US-4472403-A Quinoline derivatives and pharmaceutical compositions and methods for treating cardiovascular disease with such compounds A.C.F. CHEMIEFARMA N.V. (NL) 1984-09-18 — — US disclosed
US-4443453-A HYPOTENSIVE, VASODILATION, ANTIARRHYTHMIA, ANTICOAGULANTS ACF CHEMIEFARMA N.V. (NL) 1984-04-17 — — US disclosed
US-4442106-A HYPOTENSIVE, ANTIARRHYTHMIA ACF CHEMIEFARMA N.V. (NL) 1984-04-10 — — US disclosed
EP-0035820-A2 Novel quinoline derivatives, pharmaceutical compositions containing such compounds, and method for the preparation of these compounds ACF CHEMIEFARMA NV (NL) 1981-09-16 — — EP disclosed
EP-0030044-A1 Quinoline derivatives, processes for their preparation, their use, pharmaceutical compositions containing them and a method for the preparation of these pharmaceutical compositions ACF CHEMIEFARMA NV (NL) 1981-06-10 — — EP disclosed
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