SCHEMBL18802128

SCHEMBL18802128

CC1OC(CO)C(c2ccc(Cl)cc2Cl)O1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
SLC5A2 P31639 4/20 0.38
GAA P10253 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
TSHR P16473 1/20 0.36
AGTR1 P30556 1/20 0.36
MAPT P10636 2/20 0.35
THRB P10828 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
USP2 O75604 1/20 0.35
DPP4 P27487 1/20 0.35
TRPM5 Q9NZQ8 1/20 0.35
LGALS8 O00214 1/20 0.34

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
SCHEMBL15539507 1.00 KDM4E (0.41) KDM4EALDH1A1LMNAKMT2AHTR2A
SCHEMBL30444996 1.00 KDM4E (0.41) KDM4EALDH1A1LMNAKMT2AHTR2A
SCHEMBL30443945 1.00 KDM4E (0.41) KDM4EALDH1A1LMNAKMT2AHTR2A
SCHEMBL15539169 1.00 KDM4E (0.41) KDM4EALDH1A1LMNAKMT2AHTR2A
SCHEMBL11958029 0.89 HTR2A (0.44) KDM4EALDH1A1LMNAKMT2AHTR2A
SCHEMBL18802519 0.82 HTR2A (0.37) KDM4EHTR2AHTR2CHTR2BSLC5A2
SCHEMBL15538742 0.82 HTR2A (0.37) KDM4EHTR2AHTR2CHTR2BSLC5A2
SCHEMBL30444228 0.82 HTR2A (0.37) KDM4EHTR2AHTR2CHTR2BSLC5A2
SCHEMBL15539968 0.82 HTR2A (0.37) KDM4EHTR2AHTR2CHTR2BSLC5A2
SCHEMBL20749090 0.82 HTR2A (0.37) KDM4EALDH1A1LMNAKMT2AHTR2A

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
EP-2861571-B1 PHENYLALKYL SULFAMATE COMPOUND AND MUSCLE RELAXANT COMPOSITION COMPRISING THE SAME BIO-PHARM SOLUTIONS CO LTD (KR) 2017-05-03 EP disclosed