SCHEMBL8160201

SCHEMBL8160201

O=C(c1ccc(O)cc1)c1ccc2cc(O)ccc2c1-c1cc(O)ccc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
USP2 O75604 1/20 0.44
GAA P10253 1/20 0.44
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 1/20 0.43
LIG1 P18858 1/20 0.42
HPGD P15428 3/20 0.42
MAPT P10636 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLC22A12 Q96S37 1/20 0.42
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CLK1 P49759 3/20 0.40
DYRK1A Q13627 3/20 0.40

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
SCHEMBL11620607 0.81 MEN1 (0.53) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL10526764 0.81 PTPN1 (0.49) MEN1KMT2AGAANPC1RAB9A
SCHEMBL8165414 0.79 ESR1 (0.52) MEN1KMT2ANPC1RAB9AHPGD
SCHEMBL8153524 0.77 KMT2A (0.46) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL11621961 0.77 MEN1 (0.55) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL8161985 0.76 CNR2 (0.47) MEN1KMT2AGAANPC1RAB9A
SCHEMBL8160628 0.75 MMP2 (0.47) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL8154037 0.73 KMT2A (0.43) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL8160356 0.73 SLC22A12 (0.48) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL93420 0.71 MEN1 (0.78) MEN1KMT2AUSP2GAAKEAP1

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
US-6107346-A ADMINISTERING AND AROMATIC KETONE COMPOUND ELI LILLY AND COMPANY (US) 2000-08-22 US disclosed
EP-0897903-A2 Ketone-derivatives of indene, dihydronaphthalene or naphthalene compounds for the treatment of hyperlipidemia ELI LILLY AND COMPANY (US) 1999-02-24 EP disclosed