SCHEMBL10799697

SCHEMBL10799697

O=S(=O)(O)CCCNc1cc(Cl)ccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
POLB P06746 1/20 0.46
MCL1 Q07820 1/20 0.44
CCR1 P32246 1/20 0.43
TDP1 Q9NUW8 2/20 0.40
MAPT P10636 2/20 0.39
NR4A2 P43354 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
FERMT2 Q96AC1 1/20 0.39
PKM P14618 2/20 0.39
RAB9A P51151 1/20 0.39
ATM Q13315 1/20 0.39
GAA P10253 1/20 0.38
CXCL8 P10145 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
SCHEMBL10795123 0.90 MEN1 (0.49) MEN1KMT2APOLBMCL1CCR1
SCHEMBL9762899 0.85 GAA (0.48) POLBCCR1TDP1MAPTTSHR
SCHEMBL7824863 0.83 POLB (0.45) MEN1KMT2APOLBCCR1MAPT
SCHEMBL12226555 0.81 KMT2A (0.44) MEN1KMT2AMAPTTSHRCA12
SCHEMBL11113640 0.78 MEN1 (0.49) MEN1KMT2APOLBCCR1TDP1
SCHEMBL11315772 0.77 MEN1 (0.45) MEN1KMT2APOLBMCL1TDP1
SCHEMBL11112106 0.76 CCR1 (0.46) MEN1KMT2APOLBMCL1CCR1
SCHEMBL10795105 0.76 MEN1 (0.46) MEN1KMT2AMAPTCA12CA1
SCHEMBL8968894 0.76 KMT2A (0.42) MEN1KMT2AMAPTTSHRPKM
SCHEMBL8970364 0.76 KMT2A (0.42) MEN1KMT2AMAPTTSHRPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4652634-A Water-soluble monoazo compounds containing a N-(sulfoalkyl)-aniline coupling component and a fiber-reactive group of the vinylsulfonyl series in the phenyl or benzothiazole diazo component, suitable as fiber-reactive dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-24 US disclosed
EP-0051808-B1 WATER-SOLUBLE MONOAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1984-07-04 EP disclosed
US-4430259-A Water-soluble disazo compounds suitable as fiber-reactive dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1984-02-07 US disclosed
EP-0051807-A2 Water-soluble disazo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1982-05-19 EP disclosed
EP-0051808-A2 Water-soluble monoazo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1982-05-19 EP disclosed