SCHEMBL11249539

SCHEMBL11249539

CCCCCCCCCCCCCOP(O)Oc1ccccc1C(C)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.40
CYSLTR1 Q9Y271 2/20 0.40
PPARG P37231 3/20 0.40
C5 P01031 1/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
NR1I2 O75469 1/20 0.36
CHRM2 P08172 1/20 0.36
CYP3A4 P08684 1/20 0.36
ADRA2A P08913 1/20 0.36
MAPT P10636 1/20 0.36
OPRK1 P41145 1/20 0.36
HTR2B P41595 1/20 0.36
SLC6A3 Q01959 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36

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
SCHEMBL11400960 0.81 TYR (0.42) LMNAMEN1ADRA2AMAPTOPRK1
SCHEMBL11251136 0.79 C5 (0.36) C5NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL11252594 0.78 C5 (0.37) C5
SCHEMBL3269308 0.76 KDM4E (0.45) SMN1; SMN2LMNAMEN1NR1I2CHRM2
SCHEMBL11880598 0.75 LTA4H (0.49) SMN1; SMN2LMNANR1I2CHRM2CYP3A4
SCHEMBL21802625 0.75 LTA4H (0.49) SMN1; SMN2LMNANR1I2CHRM2CYP3A4
SCHEMBL5224703 0.75 LTA4H (0.49) SMN1; SMN2LMNANR1I2CHRM2CYP3A4
SCHEMBL2591628 0.75 LTA4H (0.49) SMN1; SMN2LMNANR1I2CHRM2CYP3A4
SCHEMBL3339037 0.75 LTA4H (0.49) SMN1; SMN2LMNANR1I2CHRM2CYP3A4
SCHEMBL27576199 0.75 LTA4H (0.49) SMN1; SMN2LMNANR1I2CHRM2CYP3A4

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
US-4346025-A Stabilized vinyl chloride polymer comprising a phenylethylidene aryl phosphite ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1982-08-24 US disclosed