SCHEMBL3674256

SCHEMBL3674256

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

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL3674821 0.91 NOS2 (0.30)
SCHEMBL3678945 0.87 DHFR (0.36) POLB
SCHEMBL3674981 0.83 TLR8 (0.33)
SCHEMBL3670753 0.81 SKP2 (0.35)
SCHEMBL3668949 0.80 IKBKB (0.33) ALDH1A1
SCHEMBL3676817 0.80 ALDH1A1 (0.33) KDM4EPOLBALDH1A1
SCHEMBL3674199 0.79 KDM4E (0.33) KDM4EPOLBALDH1A1
SCHEMBL3801329 0.74 KDM4E (0.39) KDM4EPOLBALDH1A1
SCHEMBL3676615 0.74 ALDH1A1 (0.32) ALDH1A1
SCHEMBL15262 0.73 HTT (0.38) POLBALDH1A1

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