SCHEMBL27775489

SCHEMBL27775489

CC1(C)CC(CCCCCCCCCCCCNc2ncncn2)CC(C)(C)N1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
KDM4E B2RXH2 2/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
SLC2A1 P11166 1/20 0.33
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL27775969 0.99 TSHR (0.36) TSHRKDM4ELMNAGAASLC2A1
SCHEMBL8627875 0.89 TSHR (0.31) TSHR
SCHEMBL9367808 0.84 TSHR (0.36) TSHRKDM4ELMNAGAASLC2A1
SCHEMBL11168811 0.83 TSHR (0.36) TSHRKDM4ELMNAGAA
SCHEMBL27717300 0.82 TSHR (0.33) TSHR
SCHEMBL3952306 0.80 TSHR (0.30) TSHR
SCHEMBL10650353 0.79 TSHR (0.39) TSHRKDM4ELMNAGAASLC2A1
SCHEMBL11236048 0.78 KMT2A (0.46) TSHRLMNA
SCHEMBL9524836 0.78 TSHR (0.35) TSHR
SCHEMBL10811647 0.78 KMT2A (0.46) TSHRLMNA

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-103122076-A Resin composition and molded article produced from the composition MITSUI CHEMICALS INC 2013-05-29 CN disclosed
CN-101522813-A Resin composition and molded article obtained from the composition MITSUI CHEMICALS INC (JP) 2009-09-02 CN disclosed