SCHEMBL8470866

SCHEMBL8470866

O=C(OCl)c1ccc(Cl)c(Cl)c1C(=O)OCl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.35
ABL1 P00519 1/20 0.33
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
DPP4 P27487 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPK1 P28482 1/20 0.32
TTR P02766 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TP53 P04637 1/20 0.31
CASP1 P29466 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
CSNK2A1 P68400 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
SCHEMBL6563882 0.83 CYP3A4 (0.39) TSHRABL1ALDH1A1KMT2AATM
SCHEMBL3452547 0.74 DPP4 (0.44) TSHRALDH1A1KDM4EHSD17B10DPP4
SCHEMBL5030228 0.68 CYP3A4 (0.41) TSHRALDH1A1KMT2AATMCYP3A4
SCHEMBL20513001 0.68 CYP3A4 (0.41) TSHRALDH1A1KMT2AATMCYP3A4
SCHEMBL9197919 0.68 ALDH1A1 (0.48) TSHRALDH1A1KDM4EHSD17B10KMT2A
SCHEMBL13302406 0.68 CES2 (0.60) ALDH1A1KMT2AGAATDP1SMN1; SMN2
SCHEMBL1472395 0.68 TSHR (0.54) TSHRALDH1A1KDM4EHSD17B10KMT2A
SCHEMBL29684882 0.68 TSHR (0.54) TSHRALDH1A1KDM4EHSD17B10KMT2A
SCHEMBL8564289 0.68 CES2 (0.33) CES2CES1
SCHEMBL990565 0.68 CES2 (0.39) CES2CES1

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
CN-106116086-A High-strength and ageing resistance anaerobic tank 山东洁事达环保技术服务有限公司 2016-11-16 CN disclosed
US-5889076-A Radiation curable rheology modifiers HENKEL CORPORATION (US) 1999-03-30 US disclosed