SCHEMBL9860360

SCHEMBL9860360

O=C(c1ccccc1)C(CCCOC1CCCCO1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
SMN1; SMN2 Q16637 7/20 0.41
MITF O75030 5/20 0.41
ALDH1A1 P00352 3/20 0.41
HTT P42858 2/20 0.41
ATM Q13315 2/20 0.41
RAB9A P51151 2/20 0.41
GFER P55789 1/20 0.41
PAX8 Q06710 1/20 0.41
SLC6A3 Q01959 2/20 0.40
KDM4C Q9H3R0 1/20 0.40
LMNA P02545 6/20 0.39
MAPT P10636 4/20 0.39
TP53 P04637 3/20 0.39
THRB P10828 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
JAK2 O60674 1/20 0.36
HIF1A Q16665 1/20 0.36
HSP90AA1 P07900 1/20 0.35

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
SCHEMBL5725637 0.93 MEN1 (0.50) MEN1KMT2ASMN1; SMN2MITFALDH1A1
SCHEMBL21886902 0.85 SLC6A3 (0.53) MEN1KMT2AALDH1A1SLC6A3KDM4C
SCHEMBL22504269 0.85 KMT2A (0.52) MEN1KMT2ASLC6A3KDM4CTDP1
SCHEMBL21886901 0.84 MEN1 (0.49) MEN1KMT2AALDH1A1HTTRAB9A
SCHEMBL9860590 0.84 SMN1; SMN2 (0.52) MEN1KMT2ASMN1; SMN2MITFALDH1A1
SCHEMBL21374326 0.82 MEN1 (0.49) MEN1KMT2AALDH1A1RAB9ASLC6A3
SCHEMBL9860310 0.79 MEN1 (0.53) MEN1KMT2ASMN1; SMN2MITFALDH1A1
SCHEMBL5726231 0.79 KMT2A (0.53) MEN1KMT2ASMN1; SMN2MITFALDH1A1
SCHEMBL5725306 0.78 KMT2A (0.52) MEN1KMT2ASMN1; SMN2MITFALDH1A1
SCHEMBL17846111 0.77 MEN1 (0.48) MEN1KMT2AALDH1A1RAB9ASLC6A3

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
US-4996225-A Antitumor agents FARMOS GROUP LTD. (FI) 1991-02-26 US disclosed
US-4696949-A ANTITUMOR AGENTS, ANTIESTROGENS FARMOS GROUP LTD. (FI) 1987-09-29 US disclosed
EP-0095875-A2 Novel tri-phenyl alkane and alkene derivatives and their preparation and use Farmos Group Ltd. (FI) 1983-12-07 EP disclosed