SCHEMBL11208346

SCHEMBL11208346

CCCC(Cl)c1ccccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
GABRA1 P14867 1/20 0.48
GABRB2 P47870 1/20 0.48
POLB P06746 2/20 0.40
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
CA12 O43570 1/20 0.35
GMNN O75496 1/20 0.35
EGFR P00533 1/20 0.35
CA2 P00918 1/20 0.35
FYN P06241 1/20 0.35
CA3 P07451 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
MMP9 P14780 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 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
SCHEMBL28282045 0.89 TSHR (0.50) TSHRGABRA1GABRB2POLBALDH1A1
SCHEMBL29127700 0.85 TSHR (0.47) TSHRGABRA1GABRB2ALDH1A1MAPT
SCHEMBL5589049 0.85 BCHE (0.43) TSHRGABRA1GABRB2ALDH1A1LMNA
SCHEMBL11103603 0.83 TSHR (0.63) TSHRGABRA1GABRB2POLBALDH1A1
SCHEMBL1268939 0.80 TSHR (0.44) TSHRGABRA1GABRB2POLBALDH1A1
SCHEMBL983828 0.79 TSHR (0.57) TSHRGABRA1GABRB2POLBALDH1A1
SCHEMBL3001397 0.79 TSHR (0.57) TSHRGABRA1GABRB2POLBALDH1A1
SCHEMBL352351 0.78 TSHR (0.73) TSHRGABRA1GABRB2POLBALDH1A1
SCHEMBL4738271 0.78 TSHR (0.55) TSHRGABRA1GABRB2POLBALDH1A1
SCHEMBL6679941 0.78 NISCH (0.43) TSHRLMNAKDM4ECYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115144137-A Substitution method for full water test of large water treatment and storage structure 中建三局绿色产业投资有限公司 2022-10-04 CN claimed
CN-212758571-U A reation kettle agitating unit for producing chloroprene phenol aldehyde adhesive 常熟市江南粘合剂有限公司 2021-03-23 CN disclosed
CN-212758571-U A reation kettle agitating unit for producing chloroprene phenol aldehyde adhesive 常熟市江南粘合剂有限公司 2021-03-23 CN disclosed
EP-0005053-B1 FLAME-RETARDANT ORGANIC PHOSPHATES, THEIR PRODUCTION, AND COMPOSITIONS CONTAINING THEM FMC Corporation (US) 1983-05-25 EP disclosed
US-4246169-A Flammable plastics containing a flame retardant amount of polyarylphosphates and the polyarylphosphates FMC CORPORATION (US) 1981-01-20 US disclosed
EP-0005053-A2 Flame-retardant organic phosphates, their production, and compositions containing them FMC Corporation (US) 1979-10-31 EP disclosed