SCHEMBL8134029

SCHEMBL8134029

CCCOc1ccc2c(Cl)nc(C(=O)O)c(O)c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 4/20 0.45
▸ THRA P10827 4/20 0.45
▸ THRB P10828 4/20 0.45
▸ DHODH Q02127 1/20 0.45
▸ KMT2A Q03164 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ PDE10A Q9Y233 1/20 0.42
▸ PKM P14618 1/20 0.41
▸ BBOX1 O75936 1/20 0.40
▸ FTO Q9C0B1 1/20 0.40
▸ PLA2G2A P14555 1/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MTNR1A P48039 1/20 0.38

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
SCHEMBL8139266 0.95 THRA (0.50) EGLN1THRATHRBDHODHKMT2A
SCHEMBL8139780 0.95 THRA (0.45) EGLN1THRATHRBDHODHTSHR
SCHEMBL8134005 0.90 THRA (0.50) EGLN1THRATHRBDHODHKDM4E
SCHEMBL522867 0.86 THRA (0.64) EGLN1THRATHRBBBOX1FTO
SCHEMBL27480133 0.86 ESR1 (0.45) EGLN1THRATHRBALDH1A1CYP1A2
SCHEMBL27537886 0.84 THRA (0.45) EGLN1THRATHRBDHODHPLA2G2A
SCHEMBL27448466 0.83 ESR1 (0.47) EGLN1THRATHRBALDH1A1CYP1A2
SCHEMBL4075079 0.83 DHODH (0.49) EGLN1THRATHRBDHODHBBOX1
SCHEMBL522269 0.82 THRA (0.70) EGLN1THRATHRBBBOX1FTO
SCHEMBL522871 0.81 EGLN1 (0.49) EGLN1THRATHRBKMT2ABBOX1

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
CN-1117079-C Substituted isoquinoline-3-formamides compounds, its preparing method and its use as medicine FIBRE GENE INC (US) 2003-08-06 — — CN disclosed
US-6093730-A AN ENZYME INHIBITORS OF PROLYL-4-HYDROXYLASE FOR TREATING FIBROTIC DISORDERS AND INHIBITING COLLAGEN BIOSYNTHESIS HOECHST MARION ROUSSEL DEUTSCHLAND GMBH (DE) 2000-07-25 — — US disclosed
CN-1218802-A Substituted isoquinoline-3-formamides compounds, its preparing method and its use as medicine HOECHST MARION ROUSSEL CO LTD (DE) 1999-06-09 — — CN disclosed
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