SCHEMBL9057697

SCHEMBL9057697

CCN(CC)c1ccc(C(=S)C(=S)c2ccccc2)cc1.CCN(CC)c1ccc(C(=S)C(=S)c2ccccc2)cc1.[Ni]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.51
HDAC6 Q9UBN7 2/20 0.51
CNR2 P34972 2/20 0.49
HSD11B1 P28845 1/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
NOX1 Q9Y5S8 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
ESRRG P62508 1/20 0.46
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45

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
SCHEMBL301479 0.96 TDP1 (0.51) TDP1HDAC6CNR2HSD11B1MEN1
SCHEMBL610430 0.87 TDP1 (0.53) TDP1HDAC6CNR2HSD11B1MEN1
SCHEMBL51623 0.79 HPGD (0.63) TDP1HDAC6CNR2HSD11B1MEN1
SCHEMBL8927062 0.79 HSD11B1 (0.54) TDP1HDAC6CNR2HSD11B1MEN1
SCHEMBL609137 0.79 MEN1 (0.63) TDP1HDAC6CNR2HSD11B1MEN1
Benzophenone SCHEMBL10489584 0.79 HPGD (0.63) TDP1HDAC6CNR2HSD11B1MEN1
SCHEMBL14982110 0.79 RAB9A (0.63) TDP1HDAC6CNR2HSD11B1MEN1
SCHEMBL9839760 0.79 RAB9A (0.62) TDP1MEN1KMT2ANPC1RAB9A
SCHEMBL1811805 0.79 RAB9A (0.62) TDP1MEN1KMT2ANPC1RAB9A
SCHEMBL7166399 0.79 RAB9A (0.62) TDP1MEN1KMT2ANPC1RAB9A

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
CN-101470091-A Disulfide hybridized cyclopentadiene complex LB film used for anhydrous hydrazine detection NO 510 INST OF CHINA 5TH ACADEMY OF LAUNCHVEHICLE TECHNOLOGY GROUP (CN) 2009-07-01 CN claimed
US-5434197-A Near infra-red absorbing thermally stable polymer blend ATOHAAS B.V. (NL) 1995-07-18 US claimed
CN-101470091-A Disulfide hybridized cyclopentadiene complex LB film used for anhydrous hydrazine detection NO 510 INST OF CHINA 5TH ACADEMY OF LAUNCHVEHICLE TECHNOLOGY GROUP (CN) 2009-07-01 CN disclosed
EP-0564282-B1 Bis-dithiobenzilnickel complexes for use in near-infrared absorbing materials and benzoin derivatives as intermediates therefor JUJO PAPER CO LTD (JP) 1996-07-03 EP disclosed
US-5434197-A Near infra-red absorbing thermally stable polymer blend ATOHAAS B.V. (NL) 1995-07-18 US disclosed
EP-0564282-A2 Bis-dithiobenzilnickel complexes for usae in near-infrared absorbing materials and benzoin derivatives as intermediates therefor NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1993-10-06 EP disclosed
US-4992244-A Films of dithiolene complexes in gas-detecting microsensors THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1991-02-12 US disclosed