SCHEMBL9638795

SCHEMBL9638795

CCC(OP(O)O)(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 3/20 0.41
ALDH1A1 P00352 2/20 0.38
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.35
LMNA P02545 1/20 0.35
CYP2C19 P33261 2/20 0.34
HIF1A Q16665 1/20 0.34
CYP2D6 P10635 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
GRIN1 Q05586 4/20 0.33
GRIN2A Q12879 4/20 0.33
GRIN2D O15399 3/20 0.33
GRIN2C Q14957 3/20 0.33
GRIN2B Q13224 2/20 0.33
TAAR1 Q96RJ0 1/20 0.33
HDAC1 Q13547 1/20 0.33

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
SCHEMBL9804721 0.85 KCNN4 (0.38) KCNN4ALDH1A1ALOX15MAPK1LMNA
SCHEMBL11374241 0.83 KCNN4 (0.39) KCNN4ALDH1A1ALOX15MAPK1LMNA
SCHEMBL9304148 0.82 KIF11 (0.38) KCNN4ALDH1A1ALOX15LMNACYP2C19
SCHEMBL11124050 0.80 GAA (0.40) KCNN4CHRM2CHRM3
SCHEMBL11021431 0.80 TSHR (0.34) KCNN4ALDH1A1ALOX15MAPK1LMNA
SCHEMBL3890290 0.80 KCNN4 (0.41) KCNN4ALDH1A1ALOX15MAPK1CYP2C19
SCHEMBL1406141 0.79 GAA (0.39) ALDH1A1LMNA
SCHEMBL9446569 0.79 GAA (0.39) ALDH1A1LMNA
SCHEMBL11403332 0.79 GAA (0.39) ALDH1A1LMNA
SCHEMBL7107591 0.79 GAA (0.39) ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0334411-B1 PROCESS FOR STEREOSPECIFIC POLYMERIZATION OF ALPHA-OLEFINS AND CATALYTIC SYSTEM TO BE USED IN THIS PROCESS SOLVAY (BE) 1992-07-15 EP disclosed
EP-0334411-A1 Process for stereospecific polymerization of alpha-olefins and catalytic system to be used in this process SOLVAY (BE) 1989-09-27 EP disclosed
EP-0013382-B1 PROCESS FOR THE PREPARATION OF M-AMINO-PHENOLS BASF Aktiengesellschaft (DE) 1982-12-15 EP disclosed
EP-0034935-A1 Titanium trichloride catalyst and process for production of alpha-olefin polymers SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-09-02 EP disclosed
EP-0013382-A1 Process for the preparation of m-amino-phenols BASF Aktiengesellschaft (DE) 1980-07-23 EP disclosed
US-4187385-A TITANIUM COMPONENT COPULVERIZED WITH ORGANOALUMINUM COMPOUND AND ETHYLENE OR A-OLEFINS, PARTICLE SIZE MITSUI TOATSU CHEMICAL, INC. (JP) 1980-02-05 US disclosed
US-4067903-A Manufacture of arylamines BASF AKTIENGESELLSCHAFT (DT) 1978-01-10 US disclosed