SCHEMBL182582

SCHEMBL182582

CCCCCCCCC1(CCCCCCCC)COc2c(C(=O)O)[nH]c(C(=O)O)c2OC1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 5/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.34
PSEN1 P49768 3/20 0.33
PTPN1 P18031 1/20 0.32
PTGS2 P35354 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
SCHEMBL182721 0.83 LMNA (0.43) PRKCAMEN1KMT2A
SCHEMBL13527938 0.73 PRKCA (0.37) PRKCA
SCHEMBL13080609 0.70 PRKCA (0.32) PRKCA
SCHEMBL2342174 0.69 PRKCA (0.32) PRKCA
SCHEMBL12514135 0.69 PRKCA (0.34) PRKCA
SCHEMBL3463358 0.67 GPR84 (0.48) MEN1KMT2ATDP1PTPN1
SCHEMBL17922083 0.67 PTGS2 (0.33) PRKCAPTGS2
SCHEMBL2337038 0.66
SCHEMBL11727987 0.65 TSHR (0.40)
SCHEMBL14748861 0.65 KDM4E (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1465962-B1 ELECTROCHROMIC POLYMERS AND POLYMER ELECTROCHROMIC DEVICES UNIV FLORIDA (US) 2012-01-04 EP disclosed
EP-1465962-A1 ELECTROCHROMIC POLYMERS AND POLYMER ELECTROCHROMIC DEVICES UNIVERSITY OF FLORIDA (US) 2004-10-13 EP disclosed
US-6791738-B2 CONTROLLING COLOR, BRIGHTNESS AND ENVIRONMENTAL STABILITY; POLY- 3,4-ALKYLENEDIOXYHETEROCYCLES UNIVERSITY OF FLORIDA 2004-09-14 US disclosed
US-20030174377-A1 Electrochromic polymers and polymer electrochromic devices UNIVERSITY OF FLORIDA 2003-09-18 US disclosed
WO-2003046106-A1 ELECTROCHROMIC POLYMERS AND POLYMER ELECTROCHROMIC DEVICES UNIVERSITY OF FLORIDA (US) 2003-06-05 WO disclosed