SCHEMBL9444071

SCHEMBL9444071

CC(Cc1ccc(Oc2ccc(S(=O)(=O)c3ccc([O])cc3)cc2)cc1)c1cc[c]cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 6/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
LMNA P02545 3/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PKM P14618 2/20 0.34
MMP9 P14780 3/20 0.34
ADAMTS4 O75173 2/20 0.34
ALDH1A1 P00352 4/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MMP2 P08253 2/20 0.32
MMP3 P08254 2/20 0.32
MMP1 P03956 1/20 0.32
MMP7 P09237 1/20 0.32
MMP13 P45452 1/20 0.32
POLB P06746 2/20 0.32
MAPT P10636 1/20 0.31

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
SCHEMBL9579929 0.79 HTT (0.47) HTTSMN1; SMN2LMNATDP1L3MBTL1
SCHEMBL5664519 0.79 HTT (0.47) HTTSMN1; SMN2LMNATDP1L3MBTL1
SCHEMBL9579965 0.79 HTT (0.47) HTTSMN1; SMN2LMNATDP1L3MBTL1
SCHEMBL21446843 0.70 HTT (0.61) HTTSMN1; SMN2LMNATDP1L3MBTL1
SCHEMBL3781114 0.69 ALDH1A1 (0.42) LMNAPKMALDH1A1POLBMAPT
SCHEMBL10030394 0.67 MAPT (0.47) HTTSMN1; SMN2LMNATDP1L3MBTL1
SCHEMBL15070045 0.67 ESR1 (0.53) ESR1ESR2TDP1ALDH1A1POLB
SCHEMBL3060894 0.67 ESR1 (0.75) ESR1ESR2ALDH1A1
SCHEMBL9579795 0.67 HTT (0.41) HTTSMN1; SMN2LMNATDP1L3MBTL1
SCHEMBL9937019 0.66 ESR1 (0.52) ESR1ESR2

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-5244723-A Filaments, tow, and webs formed by hydraulic spinning KIMBERLY-CLARK CORPORATION (US) 1993-09-14 US disclosed