SCHEMBL8387102

SCHEMBL8387102

CCCCCCCCCc1ccc(OP)c(CCCCCCCCC)c1CCCCCCCCC

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.44
ALOX5 P09917 10/20 0.41
TSHR P16473 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LIPG Q9Y5X9 1/20 0.39
PTGS2 P35354 4/20 0.38
PPARA Q07869 1/20 0.37
ALDH1A1 P00352 1/20 0.37
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
HTR2A P28223 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
SCHEMBL30389428 0.87 TYR (0.47) TYRALOX5TSHRMEN1KMT2A
SCHEMBL14231001 0.87 TYR (0.47) TYRALOX5TSHRMEN1KMT2A
SCHEMBL29985818 0.87 TYR (0.47) TYRALOX5TSHRMEN1KMT2A
SCHEMBL29799516 0.87 TYR (0.47) TYRALOX5TSHRMEN1KMT2A
Hydrochloric Acid SCHEMBL28780455 0.86 TYR (0.46) TYRALOX5TSHRMEN1KMT2A
SCHEMBL7061667 0.85 TYR (0.44) TYRALOX5TSHRMEN1KMT2A
SCHEMBL11337178 0.83 TYR (0.57) TYRALOX5TSHRMEN1KMT2A
SCHEMBL7571565 0.83 TYR (0.57) TYRALOX5TSHRMEN1KMT2A
SCHEMBL1822032 0.83 TYR (0.57) TYRALOX5TSHRMEN1KMT2A
SCHEMBL30876168 0.83 TYR (0.57) TYRALOX5TSHRMEN1KMT2A

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-1454917-A Method for removing volatile components contained in high-viscosity liquid by using rotating packed bed IND TECHNOLOGY INST (CN) 2003-11-12 CN claimed
US-5863689-A PHOTOSENSITIVE LAYER COMPRISING A POLYCARBONATE COPOLYMER BINDER BASED ON BISPHENOL A AND BIPHENOL DERIVATIVES AND ALSO COMPRISING AS PHENOLIC COMPOUND HAVING STERIC HINDRANCE; HIGH SENSITIVITY; DURABILITY; SMOOTHNESS; NONCRACKING; COPIERS KONICA CORPORATION (JP) 1999-01-26 US disclosed