SCHEMBL28186209

SCHEMBL28186209

CCCCCCCCCCCCCCCCCCCCCS(=O)OCC

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.54
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
CES1 P23141 5/20 0.37
FAAH O00519 3/20 0.37
CES2 O00748 2/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL28185505 1.00 EPHX2 (0.54) EPHX2CTSLCTSBALDH1A1LMNA
SCHEMBL28185507 1.00 EPHX2 (0.54) EPHX2CTSLCTSBALDH1A1LMNA
SCHEMBL27497966 1.00 EPHX2 (0.54) EPHX2CTSLCTSBALDH1A1LMNA
SCHEMBL28185510 1.00 EPHX2 (0.54) EPHX2CTSLCTSBALDH1A1LMNA
SCHEMBL28186208 1.00 EPHX2 (0.54) EPHX2CTSLCTSBALDH1A1LMNA
SCHEMBL28186212 1.00 EPHX2 (0.54) EPHX2CTSLCTSBALDH1A1LMNA
SCHEMBL28186213 1.00 EPHX2 (0.54) EPHX2CTSLCTSBALDH1A1LMNA
SCHEMBL28853235 1.00 EPHX2 (0.54) EPHX2CTSLCTSBALDH1A1LMNA
SCHEMBL30364747 1.00 EPHX2 (0.54) EPHX2CTSLCTSBALDH1A1LMNA
Water SCHEMBL27337872 0.98 EPHX2 (0.52) EPHX2CTSLCTSBALDH1A1LMNA

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
CN-107635649-A Combination for the chemical addition agent of the water flux that improves film LG 纳米水公司 2018-01-26 CN disclosed