SCHEMBL4337116

SCHEMBL4337116

CC(C)COc1ccc(-c2cc(CCl)ccc2CCl)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 3/20 0.40
POLB P06746 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
LMNA P02545 2/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
TSHR P16473 2/20 0.40
HSD17B10 Q99714 2/20 0.40
NR1H4 Q96RI1 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALOX12 P18054 1/20 0.39
XDH P47989 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
TP53 P04637 2/20 0.38
GAA P10253 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
SCHEMBL4339135 0.85 SLC16A3 (0.39) NR1H4MEN1KMT2A
SCHEMBL4331248 0.85 ALDH1A1 (0.43) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL4343175 0.84 ALDH1A1 (0.40) ALDH1A1HPGDMEN1KMT2AHTT
SCHEMBL1446870 0.81 TDP1 (0.42) MAPTLMNANPC1RAB9AKMT2A
SCHEMBL4335776 0.79 PTPN11 (0.46) ALDH1A1HPGDLMNANPC1RAB9A
SCHEMBL4527180 0.79 MAPT (0.50) MAPTKDM4EALDH1A1HPGDPOLB
SCHEMBL7097664 0.77 GCGR (0.41) MAPTALDH1A1MEN1KMT2AALOX12
SCHEMBL4349827 0.76 BACE1 (0.42) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL6859350 0.76 GABRA1 (0.37) MAPTPOLBMEN1KMT2ATP53
SCHEMBL5885086 0.73 TLR8 (0.34) ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0975710-B2 POLYMER ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2009-06-10 EP disclosed
EP-0975710-B1 POLYMER ELECTROLUMINESCENT DEVICE KONINKL PHILIPS ELECTRONICS NV (NL) 2003-09-10 EP disclosed
EP-1310540-A1 Polymer electroluminescent device Koninklijke Philips Electronics N.V. (NL) 2003-05-14 EP disclosed
US-20020001732-A1 POLYMER ELECTROLUMINESCENT DEVICE U.S. PHILIPS CORPORATION 2002-01-03 US disclosed