SCHEMBL27652501

SCHEMBL27652501

Clc1ccc(-c2nc3ccc(Sc4ccc5nc(-c6ccc(Cl)cc6)oc5c4)cc3o2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 6/20 0.51
▸ ESR2 Q92731 6/20 0.51
▸ SMN1; SMN2 Q16637 5/20 0.51
▸ MAPT P10636 3/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ HPGD P15428 2/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ GLA P06280 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ LMNA P02545 2/20 0.50
▸ NFKB1 P19838 1/20 0.50
▸ NFKB2 Q00653 1/20 0.50
▸ RELA Q04206 1/20 0.50
▸ CASP3 P42574 1/20 0.49
▸ SENP7 Q9BQF6 1/20 0.49
▸ SENP6 Q9GZR1 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
SCHEMBL27652473 0.88 SMN1; SMN2 (0.61) ESR1ESR2SMN1; SMN2MAPTKDM4E
SCHEMBL27652503 0.87 SMN1; SMN2 (0.48) ESR1ESR2SMN1; SMN2MAPTKDM4E
SCHEMBL10590678 0.85 SMN1; SMN2 (0.61) ESR1ESR2SMN1; SMN2MAPTKDM4E
SCHEMBL27652478 0.84 HDAC6 (0.56) ESR1ESR2SMN1; SMN2MAPTKDM4E
SCHEMBL27672732 0.84 TP53 (0.54) ESR1ESR2SMN1; SMN2MAPTKDM4E
SCHEMBL2242771 0.79 NPC1 (0.72) ESR1ESR2SMN1; SMN2MAPTKDM4E
SCHEMBL17199120 0.79 NPC1 (0.81) ESR1ESR2SMN1; SMN2MAPTKDM4E
SCHEMBL27358173 0.79 ESR1 (0.53) ESR1ESR2SMN1; SMN2MAPTKDM4E
SCHEMBL2248809 0.79 ESR1 (0.81) ESR1ESR2SMN1; SMN2MAPTKDM4E
SCHEMBL30727500 0.78 SMN1; SMN2 (0.65) ESR1ESR2SMN1; SMN2MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100482717-C Polybenzole kind aryl ether monomer, copolymer and its synthesis method JINHUAN LI (CN) 2009-04-29 — — CN disclosed
CN-1869102-A Polybenzole kind aryl ether monomer, copolymer and its synthesis method LI JINHUAN (CN) 2006-11-29 — — CN disclosed
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