SCHEMBL8329919

SCHEMBL8329919

O=P(Oc1c(Cl)cccc1Cl)(Oc1c(Cl)cccc1Cl)Oc1c(Cl)cccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 2/20 0.43
KMT2A Q03164 3/20 0.42
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
INPPL1 O15357 1/20 0.37
INPP5B P32019 1/20 0.37
INPP5A Q14642 1/20 0.37
TSHR P16473 3/20 0.36
CYP3A4 P08684 1/20 0.34
POLB P06746 2/20 0.33
GAA P10253 1/20 0.33
GPR84 Q9NQS5 1/20 0.33
MAPT P10636 1/20 0.33
PTK2B Q14289 1/20 0.33
AKR1B1 P15121 1/20 0.32

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
SCHEMBL10483778 0.83 SMN1; SMN2 (0.42) SMN1; SMN2LMNAKMT2ACYP1A2CYP2A6
SCHEMBL25222316 0.81 INPPL1 (0.59) SMN1; SMN2LMNAKMT2AALDH1A1INPPL1
SCHEMBL8332872 0.81 SMN1; SMN2 (0.47) SMN1; SMN2LMNAKMT2ACYP1A2CYP2A6
SCHEMBL10965361 0.80 CYP2A6 (0.50) SMN1; SMN2LMNAKMT2ACYP1A2CYP2A6
Lithium Ion SCHEMBL8333132 0.79 GPR84 (0.44) SMN1; SMN2LMNAKMT2ACYP1A2CYP2A6
SCHEMBL11671033 0.75 CA1 (0.45) LMNAKMT2AALDH1A1MEN1TDP1
SCHEMBL5441328 0.75 SMN1; SMN2 (0.48) SMN1; SMN2LMNACYP1A2ALDH1A1TDP1
SCHEMBL2035293 0.73 LMNA (0.69) SMN1; SMN2LMNAKMT2AMEN1TSHR
SCHEMBL5852286 0.73 LMNA (0.38) SMN1; SMN2LMNAKMT2ACYP1A2CYP2A6
SCHEMBL6057396 0.73 SMN1; SMN2 (0.35) SMN1; SMN2LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5861525-A Method for preparing cyanophosphonate derivatives from phosphate esters and cyanide MONSANTO COMPANY (US) 1999-01-19 US claimed
US-3936562-A Fire retardant fabrics UNITED MERCHANTS AND MANUFACTURERS, INC. (US) 1976-02-03 US claimed
CN-107428857-B Thermally expandable microspheres and use thereof 松本油脂制药株式会社 2020-05-26 CN disclosed
US-20180056267-A1 HEAT-EXPANDABLE MICROSPHERES AND APPLICATION THEREOF MATSUMOTO YUSHI-SEIYAKU CO., LTD. (JP) 2018-03-01 US disclosed
EP-0948503-A1 PREPARATION OF CYANOPHOSPHONATES FROM PHOSPHATES AND CYANIDE MONSANTO COMPANY (US) 1999-10-13 EP disclosed
US-5861525-A Method for preparing cyanophosphonate derivatives from phosphate esters and cyanide MONSANTO COMPANY (US) 1999-01-19 US disclosed
WO-1998029424-A1 PREPARATION OF CYANOPHOSPHONATES FROM PHOSPHATES AND CYANIDE MONSANTO COMPANY (US) 1998-07-09 WO disclosed
US-3936562-A Fire retardant fabrics UNITED MERCHANTS AND MANUFACTURERS, INC. (US) 1976-02-03 US disclosed