SCHEMBL7456145

SCHEMBL7456145

CCCCCCCOc1ccc(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.54
THRB P10828 1/20 0.54
ESR1 P03372 2/20 0.48
KDM4E B2RXH2 2/20 0.46
RECQL P46063 1/20 0.46
MAPK1 P28482 5/20 0.44
MAPT P10636 4/20 0.44
NPSR1 Q6W5P4 4/20 0.44
HTT P42858 4/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
UBE2N P61088 2/20 0.44
GLA P06280 1/20 0.44
MITF O75030 1/20 0.44
STAT3 P40763 1/20 0.43
RAD52 P43351 1/20 0.43
RCE1 Q9Y256 1/20 0.43
LMNA P02545 1/20 0.43
S1PR1 P21453 1/20 0.42

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
SCHEMBL4856058 0.93 KDM4E (0.47) THRATHRBESR1KDM4ERECQL
SCHEMBL986849 0.88 KDM4E (0.49) THRATHRBKDM4ERECQLMAPK1
SCHEMBL17904684 0.86 THRA (0.45) THRATHRBESR1KDM4ERECQL
SCHEMBL12433812 0.85 THRA (0.55) THRATHRBMAPK1HTTLMNA
SCHEMBL19194972 0.85 ESR1 (0.63) THRATHRBESR1KDM4ERECQL
SCHEMBL10908205 0.84 KDM4E (0.46) THRATHRBKDM4ERECQLMAPK1
SCHEMBL2183919 0.83 THRA (0.40) THRATHRBESR1KDM4ERECQL
SCHEMBL97771 0.83 THRA (0.40) THRATHRBESR1KDM4ERECQL
SCHEMBL11213999 0.83 THRA (0.40) THRATHRBESR1KDM4ERECQL
SCHEMBL6905040 0.83 THRA (0.40) THRATHRBESR1KDM4ERECQL

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-6383276-B1 INK JET PRINTING FUJI PHOTO FILM CO., LTD. (JP) 2002-05-07 US disclosed
EP-1035172-A2 Azomethine compound and oily magenta ink FUJI PHOTO FILM CO., LTD. (JP) 2000-09-13 EP disclosed