SCHEMBL8726004

SCHEMBL8726004

CCCCCN=Nc1ccccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
MAPT P10636 2/20 0.52
HTT P42858 2/20 0.52
KMT2A Q03164 2/20 0.52
NPC1 O15118 2/20 0.52
KDM4E B2RXH2 1/20 0.52
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ATM Q13315 2/20 0.46
ALPL P05186 1/20 0.46
ALDH1A1 P00352 2/20 0.38
NAAA Q02083 1/20 0.37
CA12 O43570 3/20 0.37
CA2 P00918 3/20 0.37
CA9 Q16790 3/20 0.37
TSHR P16473 3/20 0.36
RAB9A P51151 1/20 0.36
ALPG P10696 1/20 0.35
BID P55957 1/20 0.34
BCL2L1 Q07817 1/20 0.34

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
SCHEMBL8726001 1.00 MEN1 (0.52) MEN1MAPTHTTKMT2ANPC1
SCHEMBL29279649 0.95 MEN1 (0.54) MEN1MAPTHTTKMT2ANPC1
SCHEMBL29279651 0.87 MAPT (0.58) MEN1MAPTHTTKMT2ANPC1
SCHEMBL10818206 0.80 EP300 (0.46) MEN1MAPTHTTKMT2ANPC1
SCHEMBL10818212 0.80 EP300 (0.46) MEN1MAPTHTTKMT2ANPC1
SCHEMBL7160044 0.79 MAPT (0.47) MEN1MAPTHTTKMT2ANPC1
SCHEMBL7160051 0.79 MAPT (0.47) MEN1MAPTHTTKMT2ANPC1
SCHEMBL29279653 0.79 MAPT (0.62) MEN1MAPTHTTKMT2ANPC1
SCHEMBL11279171 0.79 NPC1 (0.52) KMT2ANPC1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL11279164 0.79 NPC1 (0.52) KMT2ANPC1KDM4ESMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998023368-A1 MULTI-STEP COMBINATORIAL CHEMICAL PROCESS AND DEVICE THEREFOR IMPERIAL COLLEGE OF SCIENCE TECHNOLOGY AND MEDICINE (GB) 1998-06-04 WO disclosed
EP-0203122-B1 A PROCESS FOR PREPARING P-AMINO PHENOLS BY ELECTROLYSIS FARMACEUTISK LABORATORIUM FERRING A/S (DK) 1989-04-26 EP disclosed
US-4670112-A USING P-PHENYLAZOPHENALS FARMACEUTISK LABORATORIUM FERRING A/S (DK) 1987-06-02 US disclosed
EP-0203122-A1 A PROCESS FOR PREPARING p-AMINO PHENOLS BY ELECTROLYSIS. FERRING FARMA LAB (DK) 1986-12-03 EP disclosed
WO-1986003194-A1 A PROCESS FOR PREPARING p-AMINO PHENOLS BY ELECTROLYSIS FARMACEUTISK LABORATORIUM FERRING A/S (DK) 1986-06-05 WO disclosed
US-4118385-A GREASE THICKENING AGENTS SHELL OIL COMPANY (US) 1978-10-03 US disclosed
US-4022700-A AZOURETHANE, UREA SHELL OIL COMPANY (US) 1977-05-10 US disclosed