SCHEMBL3674199

SCHEMBL3674199

CCCc1cc(Cc2cc(CCC)c(CC)c(I)c2N)c(N)c(I)c1CC

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.30

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
SCHEMBL3671259 0.91 CHRM1 (0.30)
SCHEMBL3675789 0.87 DHFR (0.36) POLB
SCHEMBL3674215 0.83 TLR8 (0.33)
SCHEMBL3670341 0.81 SKP2 (0.35)
SCHEMBL3676817 0.80 ALDH1A1 (0.33) KDM4EALDH1A1POLB
SCHEMBL3678215 0.80 IKBKB (0.33) ALDH1A1
SCHEMBL3674256 0.79 KDM4E (0.33) KDM4EALDH1A1POLB
SCHEMBL3801329 0.74 KDM4E (0.39) KDM4EALDH1A1POLB
SCHEMBL3676615 0.74 ALDH1A1 (0.32) ALDH1A1
SCHEMBL3674821 0.73 NOS2 (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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1426392-B1 COMPOSITION FOR OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2010-02-24 EP disclosed
US-6960640-B2 Composition for optical material MITSUBISHI GAS CHEMICAL CO., LTD. (JP) 2005-11-01 US disclosed
US-20040147708-A1 Composition for optical material MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-07-29 US disclosed
EP-1426392-A1 COMPOSITION FOR OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-06-09 EP disclosed