SCHEMBL2958085

SCHEMBL2958085

O=Cc1ccc(-c2cccs2)[nH]1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.45
GFER P55789 1/20 0.45
DPP4 P27487 1/20 0.43
POLB P06746 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
ERN1 O75460 3/20 0.39
CCNB2 O95067 1/20 0.39
CDK1 P06493 1/20 0.39
CCNB1 P14635 1/20 0.39
GSK3B P49841 1/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39
CCNB3 Q8WWL7 1/20 0.39
PARP1 P09874 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PIM1 P11309 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL4024470 0.80 GAA (0.57) GAAGFERPOLBMEN1KMT2A
SCHEMBL12727897 0.78 GAA (0.55) GAAGFERPOLBMEN1KMT2A
SCHEMBL9766726 0.75 ALDH1A1 (0.53) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL18876419 0.71 MAPT (0.49) GAAGFERPOLBMEN1KMT2A
SCHEMBL18876416 0.71 GAA (0.49) GAAGFERPOLBMEN1KMT2A
SCHEMBL9143440 0.70 NPC1 (0.47) DPP4MEN1KMT2AMAPTERN1
SCHEMBL28606824 0.69 NOTUM (0.48) GAAGFERPOLBMEN1KMT2A
SCHEMBL7565683 0.69 KMT2A (0.55) GAAGFERPOLBMEN1KMT2A
SCHEMBL6550838 0.69 SMN1; SMN2 (0.50) GAAPOLBMEN1KMT2AMAPT
SCHEMBL11835474 0.69 TYMP (0.50) GAAGFERPOLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-7763439-B2 Two-photon absorbing dipyrrometheneboron difluoride dyes and their applications ARCTIC DIAGNOSTICS OY (FI) 2010-07-27 US disclosed
EP-1402263-B1 TWO-PHOTON ABSORBING DIPYRROMETHENEBORON DIFLUORIDE DYES AND THEIR APPLICATIONS ARCTIC DIAGNOSTICS OY (FI) 2009-10-28 EP disclosed
US-20040157231-A1 Two-photon absorbing dipyrromethenboron difluoride dyes and their applications ARCTIC DIAGNOSTICS OY (FI) 2004-08-12 US disclosed
EP-1402263-A1 TWO-PHOTON ABSORBING DIPYRROMETHENEBORON DIFLUORIDE DYES AND THEIR APPLICATIONS Arctic Diagnostics OY (FI) 2004-03-31 EP disclosed
WO-2003005030-A1 TWO-PHOTON ABSORBING DIPYRROMETHENEBORON DIFLUORIDE DYES AND THEIR APPLICATIONS ARCTIC DIAGNOSTICS OY (FI) 2003-01-16 WO disclosed
EP-0612336-B1 LONG WAVELENGTH CHEMICALLY REACTIVE DIPYRROMETHENEBORON DIFLUORIDE DYES AND CONJUGATES MOLECULAR PROBES INC (US) 1998-01-07 EP disclosed
US-5451663-A Fluorescent dyes MOLECULAR PROBES, INC. (US) 1995-09-19 US disclosed
EP-0612336-A1 LONG WAVELENGTH CHEMICALLY REACTIVE DIPYRROMETHENEBORON DIFLUORIDE DYES AND CONJUGATES MOLECULAR PROBES, INC. (US) 1994-08-31 EP disclosed
US-5338854-A Detectors for study of natural or synthetic lipid membranes MOLECULAR PROBES, INC. (US) 1994-08-16 US disclosed
US-5274113-A Long wavelength chemically reactive dipyrrometheneboron difluoride dyes and conjugates MOLECULAR PROBES, INC. (US) 1993-12-28 US disclosed
WO-1993009185-A1 LONG WAVELENGTH CHEMICALLY REACTIVE DIPYRROMETHENEBORON DIFLUORIDE DYES AND CONJUGATES MOLECULAR PROBES, INC. (US) 1993-05-13 WO disclosed