SCHEMBL28189341

SCHEMBL28189341

O=C(O)CC1CCC(=O)OC1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ ITGB3 P05106 2/20 0.34
▸ ITGA2B P08514 2/20 0.34
▸ ITGB2 P05107 1/20 0.34
▸ ITGB1 P05556 1/20 0.34
▸ ITGAV P06756 1/20 0.34
▸ ITGA5 P08648 1/20 0.34
▸ ITGB5 P18084 1/20 0.34
▸ ITGAL P20701 1/20 0.34
▸ FFAR1 O14842 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ CTRB1 P17538 1/20 0.33
▸ TSHR P16473 2/20 0.32
▸ PPARD Q03181 5/20 0.32
▸ ACSL1 P33121 1/20 0.32
▸ DGAT1 O75907 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
SCHEMBL1697173 0.81 FOLH1 (0.44) CTRB1TSHR
SCHEMBL273409 0.80 ITGB1 (0.41) TP53L3MBTL1ITGB3ITGA2BITGB2
SCHEMBL4194440 0.76 ALDH1A1 (0.47) ITGB3ITGA2BITGB2ITGB1ITGAV
SCHEMBL28762173 0.74 TSHR (0.36) ALDH1A1TSHR
SCHEMBL8625060 0.74 CA1 (0.37) ALDH1A1TSHR
SCHEMBL11508223 0.72 TP53 (0.38) TP53L3MBTL1ITGB3ITGA2BITGB2
SCHEMBL4206078 0.72 ALDH1A1 (0.51) ITGB3ITGA2BITGB2ITGB1ITGAV
SCHEMBL15396574 0.72 TSHR (0.31) TSHR
SCHEMBL2166841 0.71 CYP1A2 (0.41) TP53ALDH1A1TSHR
SCHEMBL3931368 0.69 CA1 (0.33) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105087019-B Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display element 奇美实业股份有限公司 2017-12-08 — — CN disclosed
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