SCHEMBL16077955

SCHEMBL16077955

C/C(=N\c1c(C(C)(C)C)cccc1C(C)(C)C)C1CCCC(/C(C)=N/c2c(C(C)(C)C)cccc2C(C)(C)C)O1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.35
▸ GABRA1 P14867 1/20 0.32
▸ GABRB2 P47870 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ ALOX12 P18054 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
SCHEMBL16077954 0.84 GRIN2D (0.41) CA2ALDH1A1TSHRTDP1LMNA
SCHEMBL16077950 0.80 SIGMAR1 (0.37) TSHRLMNA
SCHEMBL19067881 0.77 — —
SCHEMBL16077956 0.72 NOS1 (0.44) ALDH1A1LMNAALOX12
SCHEMBL7214941 0.70 CA2 (0.50) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL238957 0.70 CA2 (0.50) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL238956 0.70 CA2 (0.50) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL16077951 0.70 — —
SCHEMBL16077953 0.70 UGT2B17 (0.33) ALDH1A1
SCHEMBL16077959 0.66 GABRA1 (0.34) GABRA1GABRB2

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
US-9695260-B2 Method for producing olefin block polymer using plurality of types of transition metal catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-07-04 — — US disclosed
US-20140275429-A1 METHOD FOR PRODUCING OLEFIN BLOCK POLYMER USING PLURALITY OF TYPES OF TRANSITION METAL CATALYSTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-18 — — US disclosed
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