SCHEMBL10795153

SCHEMBL10795153

Cc1ccccc1NC(C)S(=O)(=O)O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
HPGD P15428 4/20 0.44
ALDH1A1 P00352 2/20 0.44
GAA P10253 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 3/20 0.41
P2RX7 Q99572 1/20 0.41
PGR P06401 1/20 0.40
SCN1A P35498 1/20 0.40
SCN2A Q99250 1/20 0.40
SCN3A Q9NY46 1/20 0.40
MAPT P10636 2/20 0.39
HTT P42858 2/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL10797278 0.80 KCNQ2 (0.42) NPC1RAB9AHPGD
SCHEMBL27814106 0.77 LMNA (0.45) HPGDALDH1A1GAAMAPTLMNA
SCHEMBL10800203 0.77 ALDH1A1 (0.47) ALDH1A1KDM4ETDP1POLBMAPT
SCHEMBL9761988 0.76 LMNA (0.46) ALDH1A1GAAKDM4EPOLBMAPT
SCHEMBL1608004 0.75 TDP1 (0.52) HPGDALDH1A1GAAKDM4ETDP1
SCHEMBL26385190 0.74 NPC1 (0.48) NPC1RAB9AHPGDALDH1A1GAA
SCHEMBL2230553 0.74 NPC1 (0.48) NPC1RAB9AHPGDALDH1A1GAA
SCHEMBL4750832 0.73 MAPT (0.50) NPC1RAB9AHPGDALDH1A1GAA
SCHEMBL30461968 0.73 MAPT (0.50) NPC1RAB9AHPGDALDH1A1GAA
SCHEMBL245209 0.73 MAPT (0.50) NPC1RAB9AHPGDALDH1A1GAA

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-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
US-4430259-A Water-soluble disazo compounds suitable as fiber-reactive dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1984-02-07 US disclosed