SCHEMBL11511344

SCHEMBL11511344

CCCCc1ccc2c(S(=O)(=O)O)c(CCCC)ccc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 1/20 0.36
TYR P14679 1/20 0.36
CYP1A2 P05177 2/20 0.36
TRPV1 Q8NER1 1/20 0.36
NCEH1 Q6PIU2 2/20 0.36
METAP2 P50579 1/20 0.36
SKP2 Q13309 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
PKM P14618 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
NFKB1 P19838 1/20 0.35

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
SCHEMBL27995540 0.95 KAT8 (0.41) ALDH1A1HSD17B10TYRKDM4EMEN1
SCHEMBL8026073 0.93 TLR8 (0.40) ALDH1A1HSD17B10TYRKDM4EMEN1
SCHEMBL8026398 0.93 TLR8 (0.40) ALDH1A1HSD17B10TYRKDM4EMEN1
SCHEMBL11514039 0.90 CYP1A2 (0.40) CA2SMN1; SMN2ALDH1A1HPGDHSD17B10
SCHEMBL9966618 0.85 KAT8 (0.42) CA2ALDH1A1HSD17B10TYRKDM4E
SCHEMBL49844 0.81 SLC2A1 (0.47) NCEH1TDP1L3MBTL1
SCHEMBL30510739 0.81 SLC2A1 (0.47) NCEH1TDP1L3MBTL1
SCHEMBL8026397 0.80 FUT7 (0.43) CA2LMNATSHRHIF1ATLR8
SCHEMBL8026070 0.80 FUT7 (0.43) CA2LMNATSHRHIF1ATLR8
SCHEMBL3168420 0.80 SLC2A1 (0.46) NCEH1TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4171459-A Manufacture of α-naphthol BASF AKTIENGESELLSCHAFT (DE) 1979-10-16 US disclosed