SCHEMBL10429680

SCHEMBL10429680

CCCCCCCCCCC1(C(C)=O)C=CC(c2ccc(-c3ccccc3)cc2)=CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.40
MMP9 P14780 2/20 0.40
ITGB1 P05556 1/20 0.36
ITGA4 P13612 1/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 2/20 0.34
GAA P10253 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
NCOR2 Q9Y618 1/20 0.34
RARB P10826 4/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
RARA P10276 1/20 0.34
MAPT P10636 1/20 0.34
MTOR P42345 1/20 0.34

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
SCHEMBL8780388 0.98 MMP2 (0.36) MMP2MMP9ITGB1ITGA4SOAT1
SCHEMBL27724005 0.93 HPGD (0.32) POLBHPGDGAAHDAC3HDAC1
SCHEMBL4181879 0.89 MMP2 (0.37) MMP2MMP9ALDH1A1SOAT1
SCHEMBL10440677 0.89 MMP2 (0.37) MMP2MMP9ALDH1A1SOAT1
SCHEMBL4183422 0.89 MMP2 (0.37) MMP2MMP9ALDH1A1SOAT1
SCHEMBL4184929 0.89 MMP2 (0.37) MMP2MMP9ALDH1A1SOAT1
SCHEMBL9746020 0.89 MMP2 (0.37) MMP2MMP9ALDH1A1SOAT1
Hydrochloric Acid SCHEMBL9852429 0.88 MMP2 (0.36) MMP2MMP9ITGB1ITGA4ALDH1A1
SCHEMBL27902585 0.88 MMP2 (0.35) MMP2MMP9POLBALDH1A1SOAT1
SCHEMBL10429822 0.85 RARB (0.37) MMP2MMP9RARBRARACNR2

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
EP-0360042-A1 p-Terphenyl derivatives and liquid crystalline compositions KANTO KAGAKU KABUSHIKI KAISHA (JP) 1990-03-28 EP disclosed